Basic information
- Standard SMILES
O=C(Nc1cnc(OCC(F)(F)F)c(C2CCCCC2)c1)c1ccccn1- InChIKey
HQJJNBSRMLZBLW-UHFFFAOYSA-N- Molecular formula
- C19H20F3N3O2
- Average molar mass
- 379.4 g/mol
- Monoisotopic mass
- 379.15076138
Names & identifiers
- Preferred name
- Pyridine-2-carboxylic acid [5-cyclohexyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amide
- IUPAC
- N-[5-cyclohexyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyridine-2-carboxamide
Names & synonyms
pyridine-2-carboxylic acid [5-cyclohexyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amideSCHEMBL14773904
Database identifiers
- PubChem CID
- 71509892
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 483
Related reactions
2 records
Compound notes
Loading…