2-[(4-chlorophenyl)methylsulfonylamino]benzamide

C14H13ClN2O3S — CID 2227897

IUPAC2-[(4-chlorophenyl)methylsulfonylamino]benzamide
SMILESNC(=O)c1ccccc1NS(=O)(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O3S/c15-11-7-5-10(6-8-11)9-21(19,20)17-13-4-2-1-3-12(13)14(16)18/h1-8,17H,9H2,(H2,16,18)
InChIKeyQQJPYJFXUTXRMD-UHFFFAOYSA-N
MW324.79 g/mol
LogP2.38
Rot. Bonds5

About 2-[(4-chlorophenyl)methylsulfonylamino]benzamide

2-[(4-chlorophenyl)methylsulfonylamino]benzamide (PubChem CID 2227897) has the molecular formula C14H13ClN2O3S and a molecular weight of 324.79 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methylsulfonylamino]benzamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methylsulfonylamino]benzamide
PubChem CID2227897
Molecular FormulaC14H13ClN2O3S
Molecular Weight324.79 g/mol
Exact Mass324.03
IUPAC Name2-[(4-chlorophenyl)methylsulfonylamino]benzamide
SMILESNC(=O)c1ccccc1NS(=O)(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O3S/c15-11-7-5-10(6-8-11)9-21(19,20)17-13-4-2-1-3-12(13)14(16)18/h1-8,17H,9H2,(H2,16,18)
InChIKeyQQJPYJFXUTXRMD-UHFFFAOYSA-N
XLogP2.38
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.79
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)methylsulfonylamino]-N-propylbenzamide
CID 17321566
1-(4-chlorophenyl)-N-(2-methylsulfanylphenyl)methanesulfonamide
CID 18891408
2-(2-phenylethylsulfonylamino)benzamide
CID 110756518
2-[(4-chlorophenyl)methylsulfonylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
CID 18891430
2-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]amino]benzamide
CID 1325152
2-(butylsulfonylamino)benzamide
CID 17376030
2-[(4-chloro-2-fluorophenyl)sulfonylamino]benzamide
CID 4793321
2-[(2-amino-5-chlorophenyl)sulfonylamino]benzamide
CID 60986317
1-(4-chlorophenyl)-N-(2,5-dichlorophenyl)methanesulfonamide
CID 18891286
2-[[2-[3-[(4-chlorophenyl)methylsulfonyl]indol-1-yl]acetyl]amino]benzamide
CID 30561207
1-[4-(aminomethyl)phenyl]-N-(2-fluorophenyl)methanesulfonamide
CID 29291585
2-(chloroamino)benzamide
CID 54562633

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methylsulfonylamino]benzamide?
The IUPAC name of 2-[(4-chlorophenyl)methylsulfonylamino]benzamide (CID 2227897) is 2-[(4-chlorophenyl)methylsulfonylamino]benzamide.
What is the SMILES notation for 2-[(4-chlorophenyl)methylsulfonylamino]benzamide?
The canonical SMILES for 2-[(4-chlorophenyl)methylsulfonylamino]benzamide is NC(=O)c1ccccc1NS(=O)(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)methylsulfonylamino]benzamide?
The InChIKey is QQJPYJFXUTXRMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3S/c15-11-7-5-10(6-8-11)9-21(19,20)17-13-4-2-1-3-12(13)14(16)18/h1-8,17H,9H2,(H2,16,18).
What are the key properties of 2-[(4-chlorophenyl)methylsulfonylamino]benzamide?
2-[(4-chlorophenyl)methylsulfonylamino]benzamide has a molecular weight of 324.79 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methylsulfonylamino]benzamide is sourced from PubChem (CID 2227897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).