Basic information
- Standard SMILES
Nc1cnc2cc(OCc3ccccc3C(F)(F)F)ccc2c1- InChIKey
PVVZPERIHNKELC-UHFFFAOYSA-N- Molecular formula
- C17H13F3N2O
- Average molar mass
- 318.29 g/mol
Names & identifiers
- Preferred name
- 3-Amino-7-(2-trifluoromethylbenzyloxy)quinoline
- IUPAC
- 7-[[2-(trifluoromethyl)phenyl]methoxy]quinolin-3-amine
Names & synonyms
3-amino-7-(2-trifluoromethylbenzyloxy)quinolineSCHEMBL6964309
Database identifiers
- PubChem CID
- 21469331
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 391
Related reactions
1 records
Compound notes
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