Basic information
- Standard SMILES
COc1cc(NCCc2ccc(C(F)(F)F)cn2)ccc1Cl- InChIKey
AJTCSAMTYAUMCI-UHFFFAOYSA-N- Molecular formula
- C15H14ClF3N2O
- Average molar mass
- 330.73 g/mol
Names & identifiers
- Preferred name
- (4-Chloro-3-methoxy-phenyl)-[2-(5-trifluoromethyl-pyridin-2-yl)-ethyl]-amine
- IUPAC
- 4-chloro-3-methoxy-N-[2-[5-(trifluoromethyl)-2-pyridinyl]ethyl]aniline
Names & synonyms
(4-chloro-3-methoxy-phenyl)-[2-(5-trifluoromethyl-pyridin-2-yl)-ethyl]-amineSCHEMBL265917
Database identifiers
- PubChem CID
- 58007553
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 34.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 343
Related reactions
2 records
Compound notes
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