2-phenyl-5-pyridin-2-yl-4H-pyrazol-3-one
Basic information
- CAS
21683-60-3- Standard SMILES
O=C1CC(c2ccccn2)=NN1c1ccccc1- InChIKey
DNRWJXHJUQHCAD-UHFFFAOYSA-N- Molecular formula
- C14H11N3O
- Average molar mass
- 237.26 g/mol
- Monoisotopic mass
- 237.09021198
Names & identifiers
- Preferred name
- 2-phenyl-5-pyridin-2-yl-4H-pyrazol-3-one
- IUPAC
- 2-phenyl-5-pyridin-2-yl-4H-pyrazol-3-one
- English name
- 2-phenyl-5-pyridin-2-yl-4H-pyrazol-3-one
- Molecular formula
- C14H11N3O
- Molecular weight
- 237.25664
Names & synonyms
21683-60-3NSC 1468242-phenyl-5-pyridin-2-yl-4H-pyrazol-3-oneNSC1468241-Phenyl-3-(2-pyridyl)-5-pyrazolone2-Phenyl-5-(2-pyridinyl)-2,4-dihydro-3H-pyrazol-3-oneSCHEMBL9377831DTXSID90301871DNRWJXHJUQHCAD-UHFFFAOYSA-NNSC-1468242-phenyl-5-(pyridin-2-yl)-2,4-dihydro-3H-pyrazol-3-one2-Phenyl-5-(2-pyridinyl)-2,4-dihydro-3H-pyrazol-3-one #
Database identifiers
- CAS
21683-60-3- PubChem CID
- 287259
- DTXSID
DTXSID90301871- Nikkaji
- J1.392.713H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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