N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide

C17H20N2O3S — CID 9416096

IUPACN-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C17H20N2O3S/c1-4-18-23(21,22)16-9-6-14(7-10-16)17(20)19-15-8-5-12(2)13(3)11-15/h5-11,18H,4H2,1-3H3,(H,19,20)
InChIKeyIGMNNZKETKIVHQ-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.85
Rot. Bonds5

About N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide

N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide (PubChem CID 9416096) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
PubChem CID9416096
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C17H20N2O3S/c1-4-18-23(21,22)16-9-6-14(7-10-16)17(20)19-15-8-5-12(2)13(3)11-15/h5-11,18H,4H2,1-3H3,(H,19,20)
InChIKeyIGMNNZKETKIVHQ-UHFFFAOYSA-N
XLogP2.85
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(ethylsulfamoyl)-N-(4-methylphenyl)benzamide
CID 9411634
4-(benzylsulfamoyl)-N-(3,4-dimethylphenyl)benzamide
CID 109060594
4-[[4-(ethylsulfamoyl)benzoyl]amino]benzamide
CID 9441790
4-(ethylsulfamoyl)-N-phenylbenzamide
CID 1262046
4-(ethylsulfamoyl)-N-[4-(methylcarbamoylamino)phenyl]benzamide
CID 46518600
N-(4-ethoxy-3-methoxyphenyl)-4-(ethylsulfamoyl)benzamide
CID 9102814
N-[4-(ethylsulfamoyl)phenyl]-4-phenylbenzamide
CID 1249984
4-(ethylsulfamoyl)-N-(4-methylsulfanylphenyl)benzamide
CID 9179911
N-tert-butyl-4-[[4-(ethylsulfamoyl)benzoyl]amino]benzamide
CID 46584652
4-(ethylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 9411925
N-(3,4-dipropoxyphenyl)-4-(ethylsulfamoyl)benzamide
CID 26878614
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide?
The IUPAC name of N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide (CID 9416096) is N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide is CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1.
What is the InChIKey of N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide?
The InChIKey is IGMNNZKETKIVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-4-18-23(21,22)16-9-6-14(7-10-16)17(20)19-15-8-5-12(2)13(3)11-15/h5-11,18H,4H2,1-3H3,(H,19,20).
What are the key properties of N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide?
N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-4-(ethylsulfamoyl)benzamide is sourced from PubChem (CID 9416096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).