3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide

C14H13ClN2O3S — CID 5211673

IUPAC3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H13ClN2O3S/c1-9-5-6-12(21(16,19)20)8-13(9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18)(H2,16,19,20)
InChIKeyIXJQAEQNLDRRLY-UHFFFAOYSA-N
MW324.79 g/mol
LogP2.55
Rot. Bonds3

About 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide

3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide (PubChem CID 5211673) has the molecular formula C14H13ClN2O3S and a molecular weight of 324.79 g/mol. Its IUPAC name is 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide
PubChem CID5211673
Molecular FormulaC14H13ClN2O3S
Molecular Weight324.79 g/mol
Exact Mass324.03
IUPAC Name3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide
SMILESCc1ccc(S(N)(=O)=O)cc1NC(=O)c1cccc(Cl)c1
InChIInChI=1S/C14H13ClN2O3S/c1-9-5-6-12(21(16,19)20)8-13(9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18)(H2,16,19,20)
InChIKeyIXJQAEQNLDRRLY-UHFFFAOYSA-N
XLogP2.55
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.79
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 43710895
3-fluoro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 4155198
4-chloro-N-(2-methyl-5-sulfamoylphenyl)-3-nitrobenzamide
CID 4547924
3-chloro-N-(3-sulfamoylphenyl)benzamide
CID 26580558
2-hydroxy-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 61129726
N-(4-amino-2,5-dimethylphenyl)-3-chlorobenzamide
CID 103144412
3-chloro-N-(5-cyano-2-methylphenyl)benzamide
CID 47475839
N-(5-chloro-2-methylphenyl)-3-methylbenzamide
CID 686530
N-(4-chloro-2-methylphenyl)-4-sulfamoylbenzamide
CID 26698295
3-chloro-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]benzamide
CID 46485899
6-chloro-N-(2-methyl-5-sulfamoylphenyl)pyridazine-3-carboxamide
CID 61052794
3-chloro-4-methyl-N-(2-methyl-5-sulfamoylphenyl)thiophene-2-carboxamide
CID 103405078

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide?
The IUPAC name of 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide (CID 5211673) is 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide.
What is the SMILES notation for 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide?
The canonical SMILES for 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide is Cc1ccc(S(N)(=O)=O)cc1NC(=O)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide?
The InChIKey is IXJQAEQNLDRRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3S/c1-9-5-6-12(21(16,19)20)8-13(9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide?
3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide has a molecular weight of 324.79 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide is sourced from PubChem (CID 5211673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).