Basic information
- Standard SMILES
COC(=O)C1CCC(NC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1c1ccc(F)cc1- InChIKey
ZSLUDEJRDWSHKC-UHFFFAOYSA-N- Molecular formula
- C23H22F7NO2
- Average molar mass
- 477.4 g/mol
- Monoisotopic mass
- 477.15387608
Names & identifiers
- IUPAC
- methyl 3-[1-[3,5-bis(trifluoromethyl)phenyl]ethylamino]-2-(4-fluorophenyl)cyclopentane-1-carboxylate
Database identifiers
- PubChem CID
- 18922478
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 638
Related reactions
1 records
Compound notes
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