5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

C13H20N2O3S — CID 27648413

IUPAC5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)NC(C)C)c1
InChIInChI=1S/C13H20N2O3S/c1-5-14-19(17,18)11-7-6-10(4)12(8-11)13(16)15-9(2)3/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyOLERDYHXIGRIKK-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.43
Rot. Bonds5

About 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (PubChem CID 27648413) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
PubChem CID27648413
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)NC(C)C)c1
InChIInChI=1S/C13H20N2O3S/c1-5-14-19(17,18)11-7-6-10(4)12(8-11)13(16)15-9(2)3/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyOLERDYHXIGRIKK-UHFFFAOYSA-N
XLogP1.43
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(ethylsulfamoyl)-N,2-dimethylbenzamide
CID 6461284
N-(1-amino-4-methylpentan-2-yl)-5-(ethylsulfamoyl)-2-methylbenzamide;hydrochloride
CID 119585798
N-[1-(3,4-difluorophenyl)ethyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 43003466
5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 6463060
N-(2-aminoethyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 119382412
N-butyl-5-(ethylsulfamoyl)-2-methylbenzamide
CID 35710044
N-(2-amino-1-cyclopropylethyl)-5-(ethylsulfamoyl)-2-methylbenzamide;hydrochloride
CID 119613306
5-(ethylsulfamoyl)-2-methyl-N-[2-(methylamino)ethyl]benzamide;hydrochloride
CID 119500419
5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 51233854
N-butan-2-yl-2-methyl-5-(methylsulfamoyl)benzamide
CID 42940283
N-heptan-2-yl-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 46515959
N-(5-chloro-2-methylphenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 43007142

Frequently Asked Questions

What is the IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The IUPAC name of 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (CID 27648413) is 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.
What is the SMILES notation for 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The canonical SMILES for 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is CCNS(=O)(=O)c1ccc(C)c(C(=O)NC(C)C)c1.
What is the InChIKey of 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The InChIKey is OLERDYHXIGRIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-5-14-19(17,18)11-7-6-10(4)12(8-11)13(16)15-9(2)3/h6-9,14H,5H2,1-4H3,(H,15,16).
What are the key properties of 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide has a molecular weight of 284.38 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is sourced from PubChem (CID 27648413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).