Molecule ID: 257428

IUPAC Name: 2-[5-ethyl-3-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol

Description: The molecule is a pyrazole that is 1H-pyrazole bearing an ethyl group at position 3, a 2-hydroxyphenyl group at position 2, and a 4-methoxyphenyl group at position 5. It has a role as a metabolite. It is a member of phenols, a member of pyrazoles and a monomethoxybenzene.

SMILES: CCc1[nH]nc(-c2ccc(OC)cc2)c1-c1ccccc1O

SELFIES: [C][C][C][NH1][N][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][O]

InChI: InChI=1S/C18H18N2O2/c1-3-15-17(14-6-4-5-7-16(14)21)18(20-19-15)12-8-10-13(22-2)11-9-12/h4-11,21H,3H2,1-2H3,(H,19,20)

Molecular Properties:
- Polar Surface Area: 58.1 Ų
- LogP: 4.0