Nicotinonitrile

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H4N2
Molecular Weight	104.1094
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N#CC1=CC=CN=C1

InChI

InChIKey=GZPHSAQLYPIAIN-UHFFFAOYSA-N

InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H

HIDE SMILES / InChI

Molecular Formula	C6H4N2
Molecular Weight	104.1094
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Three-dimensional open frameworks based on cobalt(II) and nickel(II) m-pyridinecarboxylates.	2001 Aug 27	11511208
Solvent dynamical control of electron-transfer rates in mixed-valence complexes observed by infrared spectral line shape coalescence.	2002 Jun 5	12033841
New 3-pyridinecarbonitrile derivatives and their antimicrobial properties.	2002 May-Jun	12197415
A rapid and sensitive fluorometric assay method for the determination of nitrilase activity.	2003 Jun	12549980
Two-dimensional metamagnet composed of cyano-bridged CuII-WV bimetallic assembly.	2003 Nov 21	14651098
Synergy between spin crossover and metallophilicity in triple interpenetrated 3D nets with the NbO structure type.	2003 Nov 26	14624540
2-(3-pyridyl)-1,3,8-triazanaphthalene, a product of the catalytic transformation of 3-cyanopyridine.	2003 Sep	12944659
Supramolecular isomerism in spin crossover networks with aurophilic interactions.	2004 Oct 21	15489974
Kinetics and mechanisms of the electron transfer reactions of oxo-centred carboxylate bridged complexes, [Fe3(mu3-O)(O2CR)6L3]ClO4, with verdazyl radicals in acetonitrile solution.	2005 Apr 21	15824792
Novel milrinone analogs of pyridine-3-carbonitrile derivatives as promising cardiotonic agents.	2005 Dec	16040161
Electron transfer kinetics and mechanistic study of the thionicotinamide coordinated to the pentacyanoferrate(III)/(II) complexes: a model system for the in vitro activation of thioamides anti-tuberculosis drugs.	2005 Feb	15621268
Mild hydrolysis of nitriles by Fusarium solani strain O1.	2006	17007419
Purification and characterization of a nitrilase from Aspergillus niger K10.	2006 Dec	17061133
Isocyanide addition to pyridinium salts. Efficient entry into substituted nicotinonitrile derivatives.	2006 Dec 7	17134273
{Fe(3CNpy)2[Cu(3CNpy)(mu-CN)2]2}: a one-dimensional cyanide-based spin-crossover coordination polymer.	2006 Jun 12	16749818
Hyperinduction of nitrilases in filamentous fungi.	2006 Nov	16909267
Reactions of sulphate radicals with substituted pyridines: a structure-reactivity correlation analysis.	2007 Dec 3	17957815
Bench scale conversion of 3-cyanopyidine to nicotinamide using resting cells of Rhodococcus rhodochrous PA-34.	2007 Mar	23100637
Novel synthesis of [1]-benzothiepino[5,4-b]pyridine-3-carbonitriles and their anti-inflammatory properties.	2007 Mar 15	17267228
Cyanopyridyl containing 1,4-dihydroindeno[1,2-c]pyrazoles as potent checkpoint kinase 1 inhibitors: improving oral biovailability.	2007 Oct 15	17768051
Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1.	2008	19287539
Design and campaign synthesis of pyridine-based histone deacetylase inhibitors.	2008 Apr 15	18378451
Optimization of crucial reaction conditions for the production of nicotinamide by nitrile hydratase using response surface methodology.	2008 Dec	18975144
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(4-ethoxy-phen-yl)nicotinonitrile.	2009 Dec 9	21580178
Optimization of 5-phenyl-3-pyridinecarbonitriles as PKCtheta inhibitors.	2009 Jul 1	19447612
New catalytic liquid-phase ammoxidation approach to the preparation of niacin (vitamin B3).	2009 Jul 7	19462987
Synthesis and therapeutic evaluation of pyridyl based novel mTOR inhibitors.	2009 Jun 1	19409777
Fluorescence properties of donor acceptor chromophores on newly synthesized pyridine-3-carbonitriles.	2009 Nov	19626428
New pyridone, thioxopyridine, pyrazolopyridine and pyridine derivatives that modulate inflammatory mediators in stimulated RAW 264.7 murine macrophage.	2009 Nov	19616348
C-5 substituted heteroaryl-3-pyridinecarbonitriles as PKCtheta inhibitors: part II.	2009 Oct 1	19703774
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,6-trimethoxy-phen-yl)nicotinonitrile.	2009 Oct 31	21578493
Purification of a hyperactive nitrile hydratase from resting cells of Rhodococcus rhodochrous PA-34.	2009 Sep	23100776
Pyridine-3-carbonitrile-chloranilic acid-acetonitrile (2/1/2).	2009 Sep 16	21577921
Dibromidobis(pyridine-3-carbonitrile-κN)zinc(II).	2010 Dec 18	21522516
6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,5-trimethoxy-phen-yl)nicotinonitrile.	2010 Feb 17	21580396
Solid and liquid charge-transfer complex formation between 1-methylnaphthalene and 1-alkyl-cyanopyridinium bis{(trifluoromethyl)sulfonyl}imide ionic liquids.	2010 Feb 28	20145851
Cloning, expression and functional analysis of nicotinate dehydrogenase gene cluster from Comamonas testosteroni JA1 that can hydroxylate 3-cyanopyridine.	2010 Jul	20119845
Generation of mutant of Rhodococcus rhodochrous PA-34 through chemical mutagenesis for hyperproduction of nitrile hydratase.	2010 Jun	20587386
6-(4-Amino-phen-yl)-2-eth-oxy-4-(2-thien-yl)nicotinonitrile.	2010 Jun 26	21588020
Optimization of 5-vinylaryl-3-pyridinecarbonitriles as PKCtheta inhibitors.	2010 Mar 15	20153643

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:12:31 GMT 2023` Edited by `admin` on `Fri Dec 15 17:12:31 GMT 2023`
Record UNII	X64V0K6260
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Nicotinonitrile

Systematic Name

English

3-PYRIDINECARBONITRILE [HSDB]

Common Name

English

NSC-17558

Code

English

3-Cyanopyridine

Systematic Name

English

3-Pyridinecarbonitrile

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

Nicotinonitrile