Molecule ID: 9692

IUPAC Name: 3-amino-1-(2-aminophenyl)propan-1-one

Description: The molecule is an aromatic ketone that is aniline substituted at position 2 by a 3-aminopropanoyl group. It has a role as a metabolite. It is a substituted aniline, a primary amino compound and an aromatic ketone.

SMILES: NCCC(=O)c1ccccc1N

SELFIES: [N][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N]

InChI: InChI=1S/C9H12N2O/c10-6-5-9(12)7-3-1-2-4-8(7)11/h1-4H,5-6,10-11H2

Molecular Properties:
- Polar Surface Area: 69.1 Ų
- LogP: 0.6