2-phenylpropylamine (CHEBI:229522)

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ChEBI Name	2-phenylpropylamine

ChEBI ID	CHEBI:229522

Definition	A phenylalkylamine that is propan-1-amine substituted by a phenyl group at position 2. It is classified as a doping agent by the World Anti-Doping Agency.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Noemi Tejera

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Formula

C9H13N

Net Charge

Average Mass

135.210

Monoisotopic Mass

135.10480

InChI

InChI=1S/C9H13N/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3

InChIKey

AXORVIZLPOGIRG-UHFFFAOYSA-N

SMILES

CC(CN)C1=CC=CC=C1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Application(s):	antihypotensive agent A cardiovascular drug that tends to raise reduced blood pressure.

ChEBI Ontology
Outgoing	2-phenylpropylamine (CHEBI:229522) has role antihypotensive agent (CHEBI:137431) 2-phenylpropylamine (CHEBI:229522) is a benzenes (CHEBI:22712) 2-phenylpropylamine (CHEBI:229522) is a phenylalkylamine (CHEBI:60977)

Incoming	(R)-2-phenylpropylamine (CHEBI:188982) is a 2-phenylpropylamine (CHEBI:229522) (S)-2-phenylpropylamine (CHEBI:229525) is a 2-phenylpropylamine (CHEBI:229522)

IUPAC Name

2-phenylpropan-1-amine

Registry Number	Type	Source
582-22-9	CAS Registry Number	NIST Chemistry WebBook

Last Modified

01 February 2024