Molecule ID: 895

IUPAC Name: 6-(6-aminohexanoylamino)hexanoic acid

Description: The molecule is the N-(6-aminohexanoyl) derivative of 6-aminohexanoic acid It derives from a hexanoic acid. It is a conjugate acid of a N-(6-aminohexanoyl)-6-aminohexanoate. It is a tautomer of a N-(6-aminohexanoyl)-6-aminohexanoic acid zwitterion.

SMILES: NCCCCCC(O)=NCCCCCC(=O)O

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

InChI: InChI=1S/C12H24N2O3/c13-9-5-1-3-7-11(15)14-10-6-2-4-8-12(16)17/h1-10,13H2,(H,14,15)(H,16,17)

Molecular Properties:
- Polar Surface Area: 92.4 Ų
- LogP: -2.1