N-(2-(3-(Trifluoromethyl)phenyl)pyrimidin-5-yl)acetamide
Basic information
- CAS
827322-75-8- Standard SMILES
CC(=O)Nc1cnc(-c2cccc(C(F)(F)F)c2)nc1- InChIKey
TUJCSIZGAVFECB-UHFFFAOYSA-N- Molecular formula
- C13H10F3N3O
- Average molar mass
- 281.23 g/mol
- Monoisotopic mass
- 281.07759644
Names & identifiers
- Preferred name
- N-(2-(3-(Trifluoromethyl)phenyl)pyrimidin-5-yl)acetamide
- IUPAC
- N-[2-[3-(trifluoromethyl)phenyl]pyrimidin-5-yl]acetamide
Names & synonyms
827322-75-8N-(2-(3-(Trifluoromethyl)phenyl)pyrimidin-5-yl)acetamideN-{2-[3-(Trifluoromethyl)phenyl]pyrimidin-5-yl}acetamideSCHEMBL6259141DTXSID10741215
Database identifiers
- CAS
827322-75-8- PubChem CID
- 69723636
- DTXSID
DTXSID10741215
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…