Basic information
- Standard SMILES
CC(F)(F)CCCCn1ccc(NC(=O)/C=C/c2cccc(C(F)(F)F)c2)n1- InChIKey
WRNDYIXLQAEGSM-BQYQJAHWSA-N- Molecular formula
- C19H20F5N3O
- Average molar mass
- 401.4 g/mol
Names & identifiers
- Preferred name
- (E)-N-[1-(5,5-Difluoro-hexyl)-1H-pyrazol-3-yl]-3-(3-trifluoromethyl-phenyl)-acrylamide
- IUPAC
- (E)-N-[1-(5,5-difluorohexyl)pyrazol-3-yl]-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Names & synonyms
(E)-N-[1-(5,5-Difluoro-hexyl)-1H-pyrazol-3-yl]-3-(3-trifluoromethyl-phenyl)-acrylamideSCHEMBL1167195
Database identifiers
- PubChem CID
- 66929080
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 538
Related reactions
1 records
Compound notes
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