Basic information
- Standard SMILES
CC(C)(Cc1ccccc1)C1=NN(C(C)(C)c2ccccc2)C(=O)C1- InChIKey
AYLCUCUBQOCFNS-UHFFFAOYSA-N- Molecular formula
- C22H26N2O
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.20451346
Names & identifiers
- Preferred name
- 3-(2-methyl-1-phenylpropan-2-yl)-1-(2-phenylpropan-2-yl)-1H-pyrazol-5(4H)-one
- IUPAC
- 5-(2-methyl-1-phenylpropan-2-yl)-2-(2-phenylpropan-2-yl)-4H-pyrazol-3-one
Names & synonyms
SCHEMBL15261446AYLCUCUBQOCFNS-UHFFFAOYSA-N3-(2-methyl-1-phenylpropan-2-yl)-1-(2-phenylpropan-2-yl)-1H-pyrazol-5(4H)-one
Database identifiers
- PubChem CID
- 86697461
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 508
Related reactions
2 records
Compound notes
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