2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide

C14H12ClNO3S — CID 892271

IUPAC2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12ClNO3S/c15-11-6-8-12(9-7-11)16-14(17)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2,(H,16,17)
InChIKeyQSFGWERUKICPEO-UHFFFAOYSA-N
MW309.77 g/mol
LogP2.75
Rot. Bonds4

About 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide

2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide (PubChem CID 892271) has the molecular formula C14H12ClNO3S and a molecular weight of 309.77 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide
PubChem CID892271
Molecular FormulaC14H12ClNO3S
Molecular Weight309.77 g/mol
Exact Mass309.02
IUPAC Name2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12ClNO3S/c15-11-6-8-12(9-7-11)16-14(17)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2,(H,16,17)
InChIKeyQSFGWERUKICPEO-UHFFFAOYSA-N
XLogP2.75
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.77
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Monoacetyldapsone
CID 11257
N-(3-chloro-2-methylphenyl)-2-(phenylsulfonyl)acetamide
CID 892315
N1-(4-chlorophenyl)-2-(2-thienylthio)acetamide
CID 2819664
Acetamide, N-[2-(phenylsulfonyl)phenyl]-
CID 365390
N-(4-((2-Chloroanilino)sulfonyl)phenyl)acetamide
CID 607660
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]acetamide
CID 720082
3-[(4-bromophenyl)sulfonyl]-N-(2-chlorophenyl)propanamide
CID 4109101
1-(4-Chlorophenyl)-3-(4-(methylsulfonyl)phenyl)urea
CID 44447101
N-(3-chlorophenyl)-3-(4-methylphenyl)sulfonylpropanamide
CID 716758
4-Acetamido-4'-chlorodiphenyl sulfone
CID 246667
S-[2-(4-chloroanilino)-2-oxoethyl] carbamothioate
CID 873475
(E)-2,3-dichloro-N-(2-chlorophenyl)-3-(phenylsulfinyl)-2-propenamide
CID 1473969

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide (CID 892271) is 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide is O=C(CS(=O)(=O)c1ccccc1)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide?
The InChIKey is QSFGWERUKICPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO3S/c15-11-6-8-12(9-7-11)16-14(17)10-20(18,19)13-4-2-1-3-5-13/h1-9H,10H2,(H,16,17).
What are the key properties of 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide?
2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide has a molecular weight of 309.77 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 892271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).