4-(2,4-dichlorobenzoyl)piperazin-2-one

C11H10Cl2N2O2 — CID 30288935

IUPAC4-(2,4-dichlorobenzoyl)piperazin-2-one
SMILESO=C1CN(C(=O)c2ccc(Cl)cc2Cl)CCN1
InChIInChI=1S/C11H10Cl2N2O2/c12-7-1-2-8(9(13)5-7)11(17)15-4-3-14-10(16)6-15/h1-2,5H,3-4,6H2,(H,14,16)
InChIKeyNUFGSEWYWVXDKS-UHFFFAOYSA-N
MW273.12 g/mol
LogP1.57
Rot. Bonds1

About 4-(2,4-dichlorobenzoyl)piperazin-2-one

4-(2,4-dichlorobenzoyl)piperazin-2-one (PubChem CID 30288935) has the molecular formula C11H10Cl2N2O2 and a molecular weight of 273.12 g/mol. Its IUPAC name is 4-(2,4-dichlorobenzoyl)piperazin-2-one.

Molecular Properties

Compound Name4-(2,4-dichlorobenzoyl)piperazin-2-one
PubChem CID30288935
Molecular FormulaC11H10Cl2N2O2
Molecular Weight273.12 g/mol
Exact Mass272.01
IUPAC Name4-(2,4-dichlorobenzoyl)piperazin-2-one
SMILESO=C1CN(C(=O)c2ccc(Cl)cc2Cl)CCN1
InChIInChI=1S/C11H10Cl2N2O2/c12-7-1-2-8(9(13)5-7)11(17)15-4-3-14-10(16)6-15/h1-2,5H,3-4,6H2,(H,14,16)
InChIKeyNUFGSEWYWVXDKS-UHFFFAOYSA-N
XLogP1.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.12
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-dichlorobenzoyl)-1,4-diazepan-5-one
CID 55027869
4-(2,4-dichlorobenzoyl)piperazine-2,6-dione
CID 66085866
4-(2-amino-4-chlorobenzoyl)-1,4-diazepan-2-one
CID 65360971
4-(4-bromo-2-fluorobenzoyl)piperazin-2-one
CID 24701148
4-(4-chloro-2-methoxybenzoyl)-1,4-diazepan-2-one
CID 62898123
1-(2,4-dichlorobenzoyl)piperidin-4-one
CID 24690626
(2,4-dichlorophenyl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 110721545
4-(2,5-dimethylbenzoyl)piperazin-2-one
CID 31096061
2,4-dichloro-N-[4-methyl-1-oxo-1-(3-oxopiperazin-1-yl)pentan-2-yl]benzamide
CID 42910019
4-[(1R,2R)-2-(2,4-dichlorophenyl)cyclopropanecarbonyl]piperazin-2-one
CID 97010771
4-(2,4-dichlorobenzoyl)piperazine-1-carbothioamide
CID 2050568
4-(4-amino-3,5-dichlorobenzoyl)piperazin-2-one
CID 82832628

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorobenzoyl)piperazin-2-one?
The IUPAC name of 4-(2,4-dichlorobenzoyl)piperazin-2-one (CID 30288935) is 4-(2,4-dichlorobenzoyl)piperazin-2-one.
What is the SMILES notation for 4-(2,4-dichlorobenzoyl)piperazin-2-one?
The canonical SMILES for 4-(2,4-dichlorobenzoyl)piperazin-2-one is O=C1CN(C(=O)c2ccc(Cl)cc2Cl)CCN1.
What is the InChIKey of 4-(2,4-dichlorobenzoyl)piperazin-2-one?
The InChIKey is NUFGSEWYWVXDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O2/c12-7-1-2-8(9(13)5-7)11(17)15-4-3-14-10(16)6-15/h1-2,5H,3-4,6H2,(H,14,16).
What are the key properties of 4-(2,4-dichlorobenzoyl)piperazin-2-one?
4-(2,4-dichlorobenzoyl)piperazin-2-one has a molecular weight of 273.12 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorobenzoyl)piperazin-2-one is sourced from PubChem (CID 30288935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).