Molecule ID: 5460093

IUPAC Name: 5-[[3-(2-hydroxyethyl)-2-methylpyridin-1-ium-1-yl]methyl]-2-methyl-1H-pyrimidin-6-one

Description: The molecule is a pyridinium ion having methyl and 2-hydroxyethyl groups at positions 2 and 3 respectively as well as a 4-hydroxy-2-methylpyrimid-5-ylmethyl attached to the nitrogen.

SMILES: Cc1ncc(C[n+]2cccc(CCO)c2C)c(O)n1

SELFIES: [C][C][=N][C][=C][Branch1][S][C][N+1][=C][C][=C][C][Branch1][Ring2][C][C][O][=C][Ring1][=Branch2][C][C][Branch1][C][O][=N][Ring2][Ring1][C]

InChI: InChI=1S/C14H17N3O2/c1-10-12(5-7-18)4-3-6-17(10)9-13-8-15-11(2)16-14(13)19/h3-4,6,8,18H,5,7,9H2,1-2H3/p+1

Molecular Properties:
- Polar Surface Area: 65.6 Ų
- LogP: -0.1