4-[(2,5-dimethylphenyl)sulfamoyl]benzamide

C15H16N2O3S — CID 27187010

IUPAC4-[(2,5-dimethylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H16N2O3S/c1-10-3-4-11(2)14(9-10)17-21(19,20)13-7-5-12(6-8-13)15(16)18/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyGEUJYPDMLJFJOB-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.20
Rot. Bonds4

About 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide

4-[(2,5-dimethylphenyl)sulfamoyl]benzamide (PubChem CID 27187010) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(2,5-dimethylphenyl)sulfamoyl]benzamide
PubChem CID27187010
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name4-[(2,5-dimethylphenyl)sulfamoyl]benzamide
SMILESCc1ccc(C)c(NS(=O)(=O)c2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C15H16N2O3S/c1-10-3-4-11(2)14(9-10)17-21(19,20)13-7-5-12(6-8-13)15(16)18/h3-9,17H,1-2H3,(H2,16,18)
InChIKeyGEUJYPDMLJFJOB-UHFFFAOYSA-N
XLogP2.20
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-methylphenyl)sulfonylamino]benzamide
CID 837332
4-bromo-N-(2,5-dimethylphenyl)benzenesulfonamide
CID 4517500
N,4-dimethyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 19062594
N-(2,5-dimethylphenyl)-4-propan-2-ylbenzenesulfonamide
CID 7573896
3-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]propanoic acid
CID 9234680
3-[(4-acetylphenyl)sulfonylamino]-4-methyl-N-(3-methylphenyl)benzenesulfonamide
CID 26950297
N-[3-(dimethylamino)propyl]-4-[(2,5-dimethylphenyl)sulfamoyl]benzamide
CID 109060255
methyl 3-[(4-methoxycarbonylphenyl)sulfonylamino]-4-methylbenzoate
CID 24510050
4-[(4-bromophenyl)sulfonylamino]-N-(2,5-dimethylphenyl)benzenesulfonamide
CID 1333820
N-(2,5-dimethylphenyl)-3-methylbenzenesulfonamide
CID 47104321
4-[(dimethylamino)methyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 56806765
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-4-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 93487088

Frequently Asked Questions

What is the IUPAC name of 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide?
The IUPAC name of 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide (CID 27187010) is 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide?
The canonical SMILES for 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide is Cc1ccc(C)c(NS(=O)(=O)c2ccc(C(N)=O)cc2)c1.
What is the InChIKey of 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide?
The InChIKey is GEUJYPDMLJFJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-10-3-4-11(2)14(9-10)17-21(19,20)13-7-5-12(6-8-13)15(16)18/h3-9,17H,1-2H3,(H2,16,18).
What are the key properties of 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide?
4-[(2,5-dimethylphenyl)sulfamoyl]benzamide has a molecular weight of 304.37 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,5-dimethylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 27187010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).