(4,5-Dihydro-5-phenyl-1H-pyrazol-1-yl)-4-pyridinylmethanone
Basic information
- CAS
121306-60-3- Standard SMILES
O=C(c1ccncc1)N1N=CCC1c1ccccc1- InChIKey
NCNSWABPPPVHPQ-UHFFFAOYSA-N- Molecular formula
- C15H13N3O
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.10586205
Names & identifiers
- Preferred name
- (4,5-Dihydro-5-phenyl-1H-pyrazol-1-yl)-4-pyridinylmethanone
- IUPAC
- (3-phenyl-3,4-dihydropyrazol-2-yl)-pyridin-4-ylmethanone
Names & synonyms
121306-60-3RefChem:1050359(4,5-Dihydro-5-phenyl-1H-pyrazol-1-yl)-4-pyridinylmethanone1-(4-Pyridylcarbonyl)-5-phenyl-2-pyrazoline5-Phenyl-1-(4-pyridinylcarbonyl)-4,5-dihydro-1H-pyrazoleCHEMBL44526781H-Pyrazole, 4,5-dihydro-5-phenyl-1-(4-pyridinylcarbonyl)-SCHEMBL9380451DTXSID30923758BDBM50513026(5-Phenyl-4,5-dihydro-1H-pyrazol-1-yl)(pyridin-4-yl)methanone
Database identifiers
- CAS
121306-60-3- PubChem CID
- 3078469
- DTXSID
DTXSID30923758- ChEMBL
CHEMBL4452678
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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