1-Acetyl-3-(2-pyridyl)-4-phenylpyrazoline
Basic information
- Standard SMILES
CC(=O)N1CC(c2ccccc2)C(c2ccccn2)=N1- InChIKey
NIYILJAJXQAIMA-UHFFFAOYSA-N- Molecular formula
- C16H15N3O
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.12151211
Names & identifiers
- Preferred name
- 1-Acetyl-3-(2-pyridyl)-4-phenylpyrazoline
- IUPAC
- 1-(4-phenyl-5-pyridin-2-yl-3,4-dihydropyrazol-2-yl)ethanone
Names & synonyms
1-Acetyl-3-(2-pyridyl)-4-phenylpyrazolineNIYILJAJXQAIMA-UHFFFAOYSA-NDTXSID4013598841-ACETYL-4-PHENYL-3-(2-PYRIDYL)-2-PYRAZOLINE2-(1-Acetyl-4-phenyl-4,5-dihydro-1H-pyrazol-3-yl)pyridine #
Database identifiers
- PubChem CID
- 613670
- DTXSID
DTXSID401359884- Nikkaji
- J183.694C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 387
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Compound notes
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