Molecule ID: 39484

IUPAC Name: 1-methyl-4-phenylpyridin-1-ium

Description: The molecule is a pyridinium ion that is N-methylpyridinium having a phenyl substituent at the 4-position. It has a role as a human xenobiotic metabolite, a herbicide, an apoptosis inducer and a neurotoxin.

SMILES: C[n+]1ccc(-c2ccccc2)cc1

SELFIES: [C][N+1][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N]

InChI: InChI=1S/C12H12N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3/q+1

Molecular Properties:
- Polar Surface Area: 3.9 Ų
- LogP: 2.7