Basic information
- Standard SMILES
O=C(CCC1CCCC1)Nc1c(Cl)cc(Br)cc1C(F)(F)F- InChIKey
BTXHEBVAXDFIHD-UHFFFAOYSA-N- Molecular formula
- C15H16BrClF3NO
- Average molar mass
- 398.64 g/mol
- Monoisotopic mass
- 397.00559
Names & identifiers
- Preferred name
- N-(4-Bromo-2-chloro-6-trifluoromethyl-phenyl)-3-cyclopentyl propionamide
- IUPAC
- N-[4-bromo-2-chloro-6-(trifluoromethyl)phenyl]-3-cyclopentylpropanamide
Names & synonyms
N-(4-Bromo-2-chloro-6-trifluoromethyl-phenyl)-3-cyclopentyl propionamideSCHEMBL1001118N-(4-bromo-2-chloro-6-trifluoromethyl phenyl)-3-cyclopentyl propionamideN-(4-Bromo-2-chloro-6-trifluoromethyl-phenyl)-3-cyclopentyl-propionamide
Database identifiers
- PubChem CID
- 58097325
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 387
Related reactions
9 records
Compound notes
Loading…