Molecule ID: 45480172

IUPAC Name: 6-cyclohexyl-4-methyl-1-oxidopyridin-2-one;2-hydroxyethylazanium

Description: The molecule is the ethanolamine salt of ciclopirox. A broad spectrum antigfungal agent, it also exhibits antibacterial activity against many Gram-positive and Gram-negative bacteria, and has anti-inflammatory properties. It is used a a topical treatment of fungal skin and nail infections. It has a role as an antibacterial agent and an antiseborrheic. It is an organoammonium salt and a hydroxypyridone antifungal drug. It contains a ciclopirox and an ethanolaminium(1+).

SMILES: Cc1cc(C2CCCCC2)n([O-])c(=[OH+])c1.NCCO

SELFIES: [C][C][C][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][N][Branch1][C][O-1][C][=Branch1][C][=OH1+1][C][=Ring1][=C].[N][C][C][O]

InChI: InChI=1S/C12H16NO2.C2H7NO/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10;3-1-2-4/h7-8,10H,2-6H2,1H3;4H,1-3H2/q-1;/p+1

Molecular Properties:
- Polar Surface Area: 91.2 Ų
- LogP: nan