2-chloro-N-sulfamoylbenzamide

C7H7ClN2O3S — CID 54547559

IUPAC2-chloro-N-sulfamoylbenzamide
SMILESNS(=O)(=O)NC(=O)c1ccccc1Cl
InChIInChI=1S/C7H7ClN2O3S/c8-6-4-2-1-3-5(6)7(11)10-14(9,12)13/h1-4H,(H,10,11)(H2,9,12,13)
InChIKeyZHPFIYIEZZBIPD-UHFFFAOYSA-N
MW234.66 g/mol
LogP0.27
Rot. Bonds2

About 2-chloro-N-sulfamoylbenzamide

2-chloro-N-sulfamoylbenzamide (PubChem CID 54547559) has the molecular formula C7H7ClN2O3S and a molecular weight of 234.66 g/mol. Its IUPAC name is 2-chloro-N-sulfamoylbenzamide.

Molecular Properties

Compound Name2-chloro-N-sulfamoylbenzamide
PubChem CID54547559
Molecular FormulaC7H7ClN2O3S
Molecular Weight234.66 g/mol
Exact Mass233.99
IUPAC Name2-chloro-N-sulfamoylbenzamide
SMILESNS(=O)(=O)NC(=O)c1ccccc1Cl
InChIInChI=1S/C7H7ClN2O3S/c8-6-4-2-1-3-5(6)7(11)10-14(9,12)13/h1-4H,(H,10,11)(H2,9,12,13)
InChIKeyZHPFIYIEZZBIPD-UHFFFAOYSA-N
XLogP0.27
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.66
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-thiophen-2-ylsulfonylbenzamide
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N-carbamothioyl-2-chlorobenzamide
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2-chloro-N-(3-chloro-4-hydroxyphenyl)benzamide
CID 5119935
2-[(2-chlorobenzoyl)amino]propanediamide
CID 31062751
N-[(4-aminophenyl)methyl]-2-chlorobenzamide
CID 39360992
2-chloro-N-(3-fluoro-5-sulfamoylphenyl)benzamide
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CID 108538189

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-sulfamoylbenzamide?
The IUPAC name of 2-chloro-N-sulfamoylbenzamide (CID 54547559) is 2-chloro-N-sulfamoylbenzamide.
What is the SMILES notation for 2-chloro-N-sulfamoylbenzamide?
The canonical SMILES for 2-chloro-N-sulfamoylbenzamide is NS(=O)(=O)NC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-sulfamoylbenzamide?
The InChIKey is ZHPFIYIEZZBIPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O3S/c8-6-4-2-1-3-5(6)7(11)10-14(9,12)13/h1-4H,(H,10,11)(H2,9,12,13).
What are the key properties of 2-chloro-N-sulfamoylbenzamide?
2-chloro-N-sulfamoylbenzamide has a molecular weight of 234.66 g/mol, XLogP of 0.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-sulfamoylbenzamide is sourced from PubChem (CID 54547559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).