CHEBI:132233 - 1-phenylpropan-2-amine

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ChEBI Name 1-phenylpropan-2-amine
ChEBI ID CHEBI:132233
Definition A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl grops has been replaced by a phenyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H13N
Net Charge 0
Average Mass 135.207
Monoisotopic Mass 135.105
InChI InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
InChIKey KWTSXDURSIMDCE-UHFFFAOYSA-N
SMILES C=1(C=CC=CC1)CC(C)N
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-phenylpropan-2-amine (CHEBI:132233) is a primary amine (CHEBI:32877)
Incoming (R)-amphetamine (CHEBI:42724) is a 1-phenylpropan-2-amine (CHEBI:132233)
(S)-amphetamine (CHEBI:4469) is a 1-phenylpropan-2-amine (CHEBI:132233)
IUPAC Name
1-phenylpropan-2-amine
Last Modified
19 June 2016
General Comment
2016-06-19 This is the entry for material with unspecified stereochemistry. There are separate entries for the individual enantiomers [(R)-amphetamine and (S)-amphetamine] and for the racemate (amphetamine).