Basic information
- Standard SMILES
C=C(c1ccc(C(F)(F)F)cc1C(F)(F)F)N1CCC(CO)CC1- InChIKey
WXGSTODWBGJOPX-UHFFFAOYSA-N- Molecular formula
- C16H17F6NO
- Average molar mass
- 353.3 g/mol
- Monoisotopic mass
- 353.12143314
Names & identifiers
- Preferred name
- (1-{1-[2,4-Bis(trifluoromethyl)phenyl]ethenyl}piperidin-4-yl)methanol
- IUPAC
- [1-[1-[2,4-bis(trifluoromethyl)phenyl]ethenyl]piperidin-4-yl]methanol
Names & synonyms
(1-{1-[2,4-bis(trifluoromethyl)phenyl]ethenyl}piperidin-4-yl)methanolSCHEMBL14780379
Database identifiers
- PubChem CID
- 86678734
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 439
Related reactions
2 records
Compound notes
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