Molecule ID: 25201146

IUPAC Name: methyl-[4-oxo-4-(6-oxo-1H-pyridin-3-yl)butyl]azanium

Description: The molecule is an organic cation that is the conjugate acid of 6-hydroxypseudooxynicotine, obtained by protonation of the secondary amino group; major species at pH 7.3. It is a conjugate acid of a 6-hydroxypseudooxynicotine.

SMILES: C[NH2+]CCCC(=O)c1ccc(O)nc1

SELFIES: [C][NH2+1][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][N][=C][Ring1][#Branch1]

InChI: InChI=1S/C10H14N2O2/c1-11-6-2-3-9(13)8-4-5-10(14)12-7-8/h4-5,7,11H,2-3,6H2,1H3,(H,12,14)/p+1

Molecular Properties:
- Polar Surface Area: 62.8 Ų
- LogP: -0.5