Basic information
- Standard SMILES
CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCNCC1c1ccc(F)cc1- InChIKey
IZQCSXYJHYBQNS-UHFFFAOYSA-N- Molecular formula
- C21H19F7N2O
- Average molar mass
- 448.4 g/mol
- Monoisotopic mass
- 448.13856037
Names & identifiers
- Preferred name
- N-[3-(4-fluorophenyl)piperidin-4-yl]-N-methyl-3,5-bis(trifluoromethyl)benzamide
- IUPAC
- N-[3-(4-fluorophenyl)piperidin-4-yl]-N-methyl-3,5-bis(trifluoromethyl)benzamide
Database identifiers
- PubChem CID
- 87629375
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 594
Related reactions
2 records
Compound notes
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