Basic information
- Standard SMILES
O=C(Nc1cnc(OCC(F)(F)F)c(C2CCCC2)c1)c1cncnc1- InChIKey
QZVIENWNFMSGPY-UHFFFAOYSA-N- Molecular formula
- C17H17F3N4O2
- Average molar mass
- 366.34 g/mol
Names & identifiers
- Preferred name
- Pyrimidine-5-carboxylic acid [5-cyclopentyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amide
- IUPAC
- N-[5-cyclopentyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyrimidine-5-carboxamide
Names & synonyms
pyrimidine-5-carboxylic acid [5-cyclopentyl-6-(2,2,2-trifluoro-ethoxy)-pyridin-3-yl]-amideSCHEMBL14773843
Database identifiers
- PubChem CID
- 71509735
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 465
Related reactions
2 records
Compound notes
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