N,N-DIMETHYLPHENETHYLAMINE, (+)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H15N
Molecular Weight	149.2328
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N-DIMETHYLPHENETHYLAMINE, (+)-

Structure Search

SMILES

C[C@@H](N(C)C)C1=CC=CC=C1

InChI

InChIKey=BVURNMLGDQYNAF-SECBINFHSA-N

InChI=1S/C10H15N/c1-9(11(2)3)10-7-5-4-6-8-10/h4-9H,1-3H3/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C10H15N
Molecular Weight	149.2328
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/20964347 | https://www.ncbi.nlm.nih.gov/pubmed/22545963

N,N'-dimethylphenethylamine (DMPEA) is an industrial flavoring agent, which can be extracted from Eria jarensis Ames. It was identified and studied as an antagonist of trace amine-associated receptors.

Originator

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Trace amine-associated receptor 5 4 Target ID: Q5QD23 Gene ID: 294123.0 Gene Symbol: Taar5 Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22545963	Agonist 2678
Trace amine-associated receptor 3 1 Target ID: Q5QD24 Gene ID: 494319.0 Gene Symbol: Taar3 Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22545963	Agonist 2678
Trace amine-associated receptor 7b 1 Target ID: Q923X8 Gene ID: 294126.0 Gene Symbol: Taar7b Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22545963	Agonist 2678
Trace amine-associated receptor 7d 1 Target ID: Q923X5 Gene ID: NA Gene Symbol: Taar7d Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22545963	Agonist 2678
Trace amine-associated receptor 8c 1 Target ID: Q923Y0 Gene ID: 319105.0 Gene Symbol: Taar8c Target Organism: Rattus norvegicus (Rat) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22545963	Agonist 2678

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
11C-labelling of dimethylphenethylamine in two different positions and biodistribution studies.	1989	2551855
Cyclopalladated compounds as chemotherapeutic agents: antitumor activity against a murine melanoma cell line.	2003 Nov 10	14506753
Chiral cyclopalladated complexes derived from N,N-dimethyl-1-phenethylamine with bridging bis(diphenylphosphine)ferrocene ligand as inhibitors of the cathepsin B activity and as antitumoral agents.	2005 Apr 15	15781414
Recent advances involving palladium (II) complexes for the cancer therapy.	2007 Sep	17896909
Charge migration following ionization in systems with chromophore-donor and amine-acceptor sites.	2008 Sep 14	19044911
Palladacycles catalyse the oxidation of critical thiols of the mitochondrial membrane proteins and lead to mitochondrial permeabilization and cytochrome c release associated with apoptosis.	2009 Jan 1	18752468
Dissociative energy flow, vibrational energy redistribution, and conformeric structural dynamics in bifunctional amine model systems.	2010 Oct 28	20593860

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Sat Dec 16 00:43:35 GMT 2023` Edited by `admin` on `Sat Dec 16 00:43:35 GMT 2023`
Record UNII	13X1WU55OQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N-DIMETHYLPHENETHYLAMINE, (+)-

Systematic Name

English

(+)-(R)-N,N-DIMETHYL-.ALPHA.-PHENYLETHYLAMINE

Systematic Name

English

BENZENEMETHANAMINE, N,N,.ALPHA.-TRIMETHYL-, (.ALPHA.R)-

Common Name

English

FEMA NO. 4248

Code

English

(+)-N,N,.ALPHA.-TRIMETHYLBENZYLAMINE

Systematic Name

English

BENZENEMETHANAMINE, N,N,.ALPHA.-TRIMETHYL-, (R)-

Systematic Name

English

(+)-N,N-DIMETHYL-.ALPHA.-METHYLBENZYLAMINE

Systematic Name

English

(R)-(+)-N,N-DIMETHYL-1-PHENYLETHYLAMINE

Systematic Name

English

(R)-(1-(DIMETHYLAMINO)ETHYL)BENZENE

Systematic Name

English

(R)-.ALPHA.-METHYLBENZYLDIMETHYLAMINE

Systematic Name

English

N,N-DIMETHYLPHENETHYLAMINE [FHFI]

Common Name

English

BENZYLAMINE, N,N,.ALPHA.-TRIMETHYL-, L-(+)-

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

N,N-DIMETHYLPHENETHYLAMINE