2-chlorobenzenesulfonamide;piperidin-2-one

C11H15ClN2O3S — CID 139048315

IUPAC2-chlorobenzenesulfonamide;piperidin-2-one
SMILESNS(=O)(=O)c1ccccc1Cl.O=C1CCCCN1
InChIInChI=1S/C6H6ClNO2S.C5H9NO/c7-5-3-1-2-4-6(5)11(8,9)10;7-5-3-1-2-4-6-5/h1-4H,(H2,8,9,10);1-4H2,(H,6,7)
InChIKeyWLWSUVWMMNSSQX-UHFFFAOYSA-N
MW290.77 g/mol
LogP1.27
Rot. Bonds1

About 2-chlorobenzenesulfonamide;piperidin-2-one

2-chlorobenzenesulfonamide;piperidin-2-one (PubChem CID 139048315) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is 2-chlorobenzenesulfonamide;piperidin-2-one.

Molecular Properties

Compound Name2-chlorobenzenesulfonamide;piperidin-2-one
PubChem CID139048315
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC Name2-chlorobenzenesulfonamide;piperidin-2-one
SMILESNS(=O)(=O)c1ccccc1Cl.O=C1CCCCN1
InChIInChI=1S/C6H6ClNO2S.C5H9NO/c7-5-3-1-2-4-6(5)11(8,9)10;7-5-3-1-2-4-6-5/h1-4H,(H2,8,9,10);1-4H2,(H,6,7)
InChIKeyWLWSUVWMMNSSQX-UHFFFAOYSA-N
XLogP1.27
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-((2-Chlorophenyl)sulfonyl)piperazin-2-one
CID 7509966
4-Chloro-N-(2-oxo-azepan-3-yl)-benzenesulfonamide
CID 2738683
N-cyclopropyl-1-(2,5-dichlorophenyl)sulfonylpiperidine-4-carboxamide
CID 3157090
1-(2-chloro-4-fluorophenyl)sulfonyl-N-cycloheptylpiperidine-4-carboxamide
CID 57398545
1-(4-chlorophenyl)sulfonyl-N-cyclopropylpiperidine-4-carboxamide
CID 856925
4-Chloro-N-[3-(4-methyl-piperidin-1-yl)-3-oxo-propyl]-benzenesulfonamide
CID 3160568
2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-cyclopentylpropanamide
CID 16312810
(3S)-1-(3-chlorophenyl)sulfonyl-N-cyclohexylpiperidine-3-carboxamide
CID 11538237
4-(2,5-Dichlorophenyl)sulfonylpiperazin-2-one
CID 2524974
4-chloro-N-(16-oxo-azacyclohexadec-5-yl)benzenesulfonamide
CID 25023502
2-chloro-N-(16-oxo-azacyclohexadec-5-yl)benzenesulfonamide
CID 25023562
N-(2-{1-[(3-chlorophenyl)sulfonyl]-2-piperidinyl}ethyl)acetamide
CID 70760741

Frequently Asked Questions

What is the IUPAC name of 2-chlorobenzenesulfonamide;piperidin-2-one?
The IUPAC name of 2-chlorobenzenesulfonamide;piperidin-2-one (CID 139048315) is 2-chlorobenzenesulfonamide;piperidin-2-one.
What is the SMILES notation for 2-chlorobenzenesulfonamide;piperidin-2-one?
The canonical SMILES for 2-chlorobenzenesulfonamide;piperidin-2-one is NS(=O)(=O)c1ccccc1Cl.O=C1CCCCN1.
What is the InChIKey of 2-chlorobenzenesulfonamide;piperidin-2-one?
The InChIKey is WLWSUVWMMNSSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClNO2S.C5H9NO/c7-5-3-1-2-4-6(5)11(8,9)10;7-5-3-1-2-4-6-5/h1-4H,(H2,8,9,10);1-4H2,(H,6,7).
What are the key properties of 2-chlorobenzenesulfonamide;piperidin-2-one?
2-chlorobenzenesulfonamide;piperidin-2-one has a molecular weight of 290.77 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorobenzenesulfonamide;piperidin-2-one is sourced from PubChem (CID 139048315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).