Basic information
- Standard SMILES
CN1CC=C(c2cccc(C(F)(F)F)c2)n2ncc(C#N)c21- InChIKey
HRFDIFUPEJKVDA-UHFFFAOYSA-N- Molecular formula
- C15H11F3N4
- Average molar mass
- 304.27 g/mol
Names & identifiers
- Preferred name
- 4,5-Dihydro-4-methyl-7-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
- IUPAC
- 4-methyl-7-[3-(trifluoromethyl)phenyl]-5H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Names & synonyms
4,5-Dihydro-4-methyl-7-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrileSCHEMBL10556649
Database identifiers
- PubChem CID
- 14501855
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 507
Related reactions
2 records
Compound notes
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