Molecule ID: 34313

IUPAC Name: 2,4,5-trimethyl-N-phenylfuran-3-carboxamide

Description: The molecule is a secondary carboxamide resulting from the formal condensation of the carboxylic acid group of 2,4,5-trimethyl-3-furoic acid with the amino group of aniline. An obsolete fungicide formerly used to control Basidiomycetes pathogens on cereal crops. It has a role as an antifungal agrochemical. It is an anilide, a secondary carboxamide, a member of furans and a furanilide fungicide.

SMILES: Cc1oc(C)c(C(O)=Nc2ccccc2)c1C

SELFIES: [C][C][O][C][Branch1][C][C][=C][Branch1][=C][C][Branch1][C][O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][#C][C]

InChI: InChI=1S/C14H15NO2/c1-9-10(2)17-11(3)13(9)14(16)15-12-7-5-4-6-8-12/h4-8H,1-3H3,(H,15,16)

Molecular Properties:
- Polar Surface Area: 42.2 Ų
- LogP: 3.0