Molecule ID: 295606

IUPAC Name: 3-aminooctanoic acid

Description: The molecule is a beta-amino acid that is caprylic acid which is substituted by an amino group at position 3. It has a role as a metabolite. It is a beta-amino acid and a beta-amino-fatty acid. It derives from an octanoic acid.

SMILES: CCCCCC(N)CC(=O)O

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

InChI: InChI=1S/C8H17NO2/c1-2-3-4-5-7(9)6-8(10)11/h7H,2-6,9H2,1H3,(H,10,11)

Molecular Properties:
- Polar Surface Area: 63.3 Ų
- LogP: -1.1