Molecule ID: 44514625

IUPAC Name: (2R,5S)-2,5-diaminohexanoic acid

Description: The molecule is a diamino acid that is hexanoic acid carrying two amino substituents at positions 2 and 5 (the 2R,5S-diastereomer). It derives from a D-norleucine. It is a conjugate base of a (2R,5S)-2,5-diammoniohexanoate.

SMILES: C[C@H](N)CC[C@@H](N)C(=O)O

SELFIES: [C][C@H1][Branch1][C][N][C][C][C@@H1][Branch1][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H14N2O2/c1-4(7)2-3-5(8)6(9)10/h4-5H,2-3,7-8H2,1H3,(H,9,10)/t4-,5+/m0/s1

Molecular Properties:
- Polar Surface Area: 89.3 Ų
- LogP: -3.2