PROPIONAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H7NO
Molecular Weight	73.0938
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC(N)=O

InChI

InChIKey=QLNJFJADRCOGBJ-UHFFFAOYSA-N

InChI=1S/C3H7NO/c1-2-3(4)5/h2H2,1H3,(H2,4,5)

HIDE SMILES / InChI

Molecular Formula	C3H7NO
Molecular Weight	73.0938
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/29486445

Propionamide could effectively control the expansion of M. flos-aquae colonies without potential risks to the ecological safety of aquatic environments, therefore, propionamide can actually be used to regulate cyanobacterial blooms in natural waters.

Approval Year

PubMed

Title	Date	PubMed
Hepatocellular toxicity and pharmacological effect of amiodarone and amiodarone derivatives.	2006-12	16971508
Solution structure of the aqueous model peptide N-methylacetamide.	2006-10-26	17048961
A Kirkwood-Buff derived force field for amides.	2006-10	16823811
Incidence of dimethylacetamide induced hepatic injury among new employees in a cohort of elastane fibre workers.	2006-10	16728503
The anharmonic vibrational potential and relaxation pathways of the amide I and II modes of N-methylacetamide.	2006-09-28	16986892
Fluoroolefins as peptide mimetics: a computational study of structure, charge distribution, hydration, and hydrogen bonding.	2006-09-28	16986846
Charge-transfer transitions in protein circular dichroism calculations.	2006-09-27	16984181
A study of N-methylacetamide in water clusters: based on atom-bond electronegativity equalization method fused into molecular mechanics.	2006-08-14	16942290
Ab initio and empirical model MD simulation studies of solvent effects on the properties of N-methylacetamide along a cis-trans isomerization pathway.	2006-07-13	16821879
Microenvironment control of methyl rotation induced by proton transfer.	2006-06-22	16774216
Theoretical and experimental investigation of the energetics of cis-trans proline isomerization in peptide models.	2006-05-25	16706410
Enthalpies of hydration of N-methylacetamide by one, two, and three waters and the effect upon the C=O stretching frequency. An Ab initio DFT study.	2006-05-04	16640374
Dynamic coupling between coordinates in a model for biomolecular isomerization.	2006-04-14	16626249
Time-dependent perturbation theory for vibrational energy relaxation and dephasing in peptides and proteins.	2006-04-14	16626248
Geometry and solvent dependence of the electronic spectra of the amide group and consequences for peptide circular dichroism.	2006-04-13	16599437
Structural properties of liquid N-methylacetamide via ab initio, path integral, and classical molecular dynamics.	2006-03-07	16526863
Structure and hydrogen bonding in neat N-methylacetamide: classical molecular dynamics and Raman spectroscopy studies of a liquid of peptidic fragments.	2006-03-02	16494418
Pharmacokinetics and metabolism of a selective androgen receptor modulator in rats: implication of molecular properties and intensive metabolic profile to investigate ideal pharmacokinetic characteristics of a propanamide in preclinical study.	2006-03	16381665
Simulation protocols for coherent femtosecond vibrational spectra of peptides.	2006-02-23	16494351
Hydroxylated poly(N-isopropylacrylamide) as functional thermoresponsive materials.	2006-02	16471928
A transferable electrostatic map for solvation effects on amide I vibrations and its application to linear and two-dimensional spectroscopy.	2006-01-28	16460180
Identification of an unusual naturally occurring apolar fatty acid amide in mammalian brain and a method for its quantitative determination.	2006	16372384
Solvent friction effect on intramolecular electron transfer.	2005-12-21	16351118
Fabrication and characterization of DTBP-crosslinked chitosan scaffolds for skin tissue engineering.	2005-12	16011846
Electrostatic DFT map for the complete vibrational amide band of NMA.	2005-11-03	16833288
Application of Fourier transform infrared spectroscopy for monitoring hydrolysis and synthesis reactions catalyzed by a recombinant amidase.	2005-11-01	16185648
Activity coefficients and thermodynamic parameters for RbCl/CsCl + amide (acetamide, propanamide, and n-butanamide) + water system at 298.15 K.	2005-10-22	16039039
Transferable potentials for phase equilibria. 7. Primary, secondary, and tertiary amines, nitroalkanes and nitrobenzene, nitriles, amides, pyridine, and pyrimidine.	2005-10-13	16853443
IR spectra of N-methylacetamide in water predicted by combined quantum mechanical/molecular mechanical molecular dynamics simulations.	2005-10-01	16223310
FR177391, a new anti-hyperlipidemic agent from Serratia. I. Taxonomy, fermentation, isolation, physico-chemical properties, structure elucidation and biological activities.	2005-10	16392679
Synthesis of some 2(3H)-benzoxazolone derivatives and their in-vitro effects on human leukocyte myeloperoxidase activity.	2005-09	16143956
Lennard-Jones parameters for the combined QM/MM method using the B3LYP/6-31G*/AMBER potential.	2005-09	15965971
Comment on "Strength of the N-H...O=C bonds in formamide and N-methylacetamide dimers".	2005-08-11	16834059
Amide I vibrational dynamics of N-methylacetamide in polar solvents: the role of electrostatic interactions.	2005-06-02	16852342
How to model solvation of peptides? Insights from a quantum mechanical and molecular dynamics study of N-methylacetamide. 2. 15N and 17O nuclear shielding in water and in acetone.	2005-05-19	16852183
How to model solvation of peptides? Insights from a quantum-mechanical and molecular dynamics study of N-methylacetamide. 1. Geometries, infrared, and ultraviolet spectra in water.	2005-05-19	16852182
Thermosensitive biodegradable polydepsipeptide.	2005-04-19	15818579
Empirical solvent correction for multiple amide group vibrational modes.	2005-04-08	15847539
[(S)-1-Carbamoylethyl]bis(dimethylglyoximato-kappa2N,N')[(S)-1-phenylethylamine]cobalt(III) and bis(dimethylglyoximato-kappa2N,N')[(R)-1-(N-methylcarbamoyl)ethyl][(R)-1-phenylethylamine]cobalt(III) monohydrate.	2005-04	15805618
Understanding the energetics of helical peptide orientation in membranes.	2005-03-01	15657932
Effect of temperature and concentration on the structure of N-methylacetamide-water complexes: Near-infrared spectroscopic study.	2005-02-17	16833408
Toward a general mechanism of electron capture dissociation.	2005-02	15694771
Electron correlation as the driving force for charge transfer: charge migration following ionization in N-methyl acetamide.	2005-01-27	16833360
X-ray scattering and density-functional theory calculations to study the presence of hydrogen-bonded clusters in liquid N-methylacetamide.	2005-01-08	15638593
Amide derivatives of 9,11-seco-estra-1,3,5(10)-trien-11-oic acid as modified orally active estrogen agonists with moderate antagonistic activity.	2005-01-03	15582419
A theoretical study of polarization effects on a model peptide bond.	2005-01	15710664
New aspects on the formation and analysis of acrylamide.	2005	16438300
Acrylamide formation in different foods and potential strategies for reduction.	2005	16438297
Photo-fenton assisted reaction of dimethoate in aqueous solutions.	2005	15825680
Asparagine and glutamine side-chain conformation in solution and crystal: a comparison for hen egg-white lysozyme using residual dipolar couplings.	2004-11	15754058

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:13:33 GMT 2025` Edited by `admin` on `Mon Mar 31 21:13:33 GMT 2025`
Record UNII	QK07G0HP47
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-38708

Preferred Name

English

PROPIONAMIDE

Systematic Name

English

PROPANIMIDIC ACID

Systematic Name

English

PROPYLAMIDE

Systematic Name

English

PROPIONAMIDE [MI]

Common Name

English

PROPIONIC ACID AMIDE

Systematic Name

English

PROPANAMIDE

Systematic Name

English

Code System Code Type Description

NSC

38708