(R)-2-propionamido-N-(1-(3-(trifluoromethyl)phenyl)ethyl)pyrimidine-4-carboxamide
Basic information
- Standard SMILES
CCC(=O)Nc1nccc(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)n1- InChIKey
NHIHDWMEJXQLDG-SNVBAGLBSA-N- Molecular formula
- C17H17F3N4O2
- Average molar mass
- 366.34 g/mol
- Monoisotopic mass
- 366.13036028
Names & identifiers
- Preferred name
- (R)-2-propionamido-N-(1-(3-(trifluoromethyl)phenyl)ethyl)pyrimidine-4-carboxamide
- IUPAC
- 2-(propanoylamino)-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]pyrimidine-4-carboxamide
Names & synonyms
(R)-2-propionamido-N-(1-(3-(trifluoromethyl)phenyl)ethyl)pyrimidine-4-carboxamideSCHEMBL2713792
Database identifiers
- PubChem CID
- 67508804
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 501
Related reactions
1 records
Compound notes
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