Molecule ID: 1182

IUPAC Name: 2-amino-3-methylbutanoic acid

Description: The molecule is a branched-chain amino acid that consists of glycine in which one of the hydrogens attached to the alpha-carbon is substituted by an isopropyl group. It has a role as a plant metabolite and a Daphnia magna metabolite. It is a branched-chain amino acid and an alpha-amino acid. It contains an isopropyl group. It is a conjugate base of a valinium. It is a conjugate acid of a valinate.

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

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

InChI: InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)

Molecular Properties:
- Polar Surface Area: 63.3 Ų
- LogP: -2.3