Molecule ID: 91755

IUPAC Name: 5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3-one

Description: The molecule is a member of the class of furans that is furan-3(2H)-one which is substituted at positions 2, 4, and 5 by phenyl, m-(trifluoromethyl)phenyl, and methylamino groups, respectively. It is a member of furans, a cyclic ketone, a secondary amino compound and a member of (trifluoromethyl)benzenes.

SMILES: CNC1=C(c2cccc(C(F)(F)F)c2)C(=O)C(c2ccccc2)O1

SELFIES: [C][N][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][=Branch1]

InChI: InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3

Molecular Properties:
- Polar Surface Area: 38.3 Ų
- LogP: 4.5