4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one

C18H18N2O3 — CID 110878709

IUPAC4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one
SMILESO=C1CN(C(=O)C(O)(c2ccccc2)c2ccccc2)CCN1
InChIInChI=1S/C18H18N2O3/c21-16-13-20(12-11-19-16)17(22)18(23,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,23H,11-13H2,(H,19,21)
InChIKeyPQPPEUVSWXLLCA-UHFFFAOYSA-N
MW310.35 g/mol
LogP0.88
Rot. Bonds3

About 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one

4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one (PubChem CID 110878709) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one.

Molecular Properties

Compound Name4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one
PubChem CID110878709
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one
SMILESO=C1CN(C(=O)C(O)(c2ccccc2)c2ccccc2)CCN1
InChIInChI=1S/C18H18N2O3/c21-16-13-20(12-11-19-16)17(22)18(23,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,23H,11-13H2,(H,19,21)
InChIKeyPQPPEUVSWXLLCA-UHFFFAOYSA-N
XLogP0.88
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 62487867
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4-(2,2,2-trifluoroacetyl)piperazin-2-one
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4-(2-amino-2-methylpropanoyl)piperazin-2-one;hydrochloride
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4-(2,2-dimethylbutanoyl)piperazin-2-one
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CID 130266300
1-(4-acetylpiperazin-1-yl)-2,2-dimethylpropan-1-one;4-(2,2-dimethylpropanoyl)piperazin-2-one
CID 160882025
4-[2-(4-fluoroindol-1-yl)-2-methylpropanoyl]piperazin-2-one
CID 141178963
4-(2-phenylpentanoyl)piperazin-2-one
CID 42910023
4-[2-(4-fluorophenoxy)-2-methylpropanoyl]piperazin-2-one
CID 60656740
2-methyl-2-(3-oxopiperazine-1-carbonyl)butanethioamide
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4-acetylpiperazin-2-one
CID 12744517

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one?
The IUPAC name of 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one (CID 110878709) is 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one.
What is the SMILES notation for 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one?
The canonical SMILES for 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one is O=C1CN(C(=O)C(O)(c2ccccc2)c2ccccc2)CCN1.
What is the InChIKey of 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one?
The InChIKey is PQPPEUVSWXLLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c21-16-13-20(12-11-19-16)17(22)18(23,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,23H,11-13H2,(H,19,21).
What are the key properties of 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one?
4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one has a molecular weight of 310.35 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxy-2,2-diphenylacetyl)piperazin-2-one is sourced from PubChem (CID 110878709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).