1,5-Dimethyl-2-phenyl-4-propan-2-ylpyrazolidin-3-one

HCID 329092

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Basic information

CAS: 4200-39-9
Standard SMILES: CC(C)C1C(=O)N(c2ccccc2)N(C)C1C
InChIKey: FDUCDNUJUOMPRC-UHFFFAOYSA-N
Molecular formula: C14H20N2O
Average molar mass: 232.32 g/mol
Monoisotopic mass: 232.15756327

Names & identifiers

Preferred name: 1,5-Dimethyl-2-phenyl-4-propan-2-ylpyrazolidin-3-one
IUPAC: 1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazolidin-3-one

Names & synonyms

1,5-dimethyl-2-phenyl-4-propan-2-ylpyrazolidin-3-one4200-39-9DTXSID30317037RefChem:221326DTXCID20268160NSC310218SCHEMBL19829483NSC-3102181,5-Dimethyl-2-phenyl-4-(propan-2-yl)pyrazolidin-3-onedihydro-1,5-dimethyl-4-(1-methylethyl)-2-phenylpyrazol-3-one

Database identifiers

CAS: 4200-39-9
PubChem CID: 329092
DTXSID: DTXSID30317037

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 23.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 284

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