Molecule ID: 7408076

IUPAC Name: 2-[[(2S)-pyrrolidin-1-ium-2-carbonyl]amino]acetate

Description: The molecule is the zwitterion of L-prolinylglycine resulting from the transfer of a proton from the hydroxy group of glycine to the amino group of proline. Major microspecies at pH 7.3. It is a tautomer of a L-prolylglycine.

SMILES: O=C(O)CN=C(O)[C@@H]1CCCN1

SELFIES: [O][=C][Branch1][C][O][C][N][=C][Branch1][C][O][C@@H1][C][C][C][N][Ring1][Branch1]

InChI: InChI=1S/C7H12N2O3/c10-6(11)4-9-7(12)5-2-1-3-8-5/h5,8H,1-4H2,(H,9,12)(H,10,11)/t5-/m0/s1

Molecular Properties:
- Polar Surface Area: 85.8 Ų
- LogP: -2.4