4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide

C19H24N2O3S — CID 51310180

IUPAC4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide
SMILESCc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1
InChIInChI=1S/C19H24N2O3S/c1-13-7-6-8-14(2)17(13)20-18(22)15-9-11-16(12-10-15)25(23,24)21-19(3,4)5/h6-12,21H,1-5H3,(H,20,22)
InChIKeyAPOLPHOHRDYQDM-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.63
Rot. Bonds4

About 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide

4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide (PubChem CID 51310180) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide.

Molecular Properties

Compound Name4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide
PubChem CID51310180
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide
SMILESCc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1
InChIInChI=1S/C19H24N2O3S/c1-13-7-6-8-14(2)17(13)20-18(22)15-9-11-16(12-10-15)25(23,24)21-19(3,4)5/h6-12,21H,1-5H3,(H,20,22)
InChIKeyAPOLPHOHRDYQDM-UHFFFAOYSA-N
XLogP3.63
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(tert-butylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 46689119
4-(tert-butylsulfamoyl)-N-(2,6-diethylphenyl)benzamide
CID 51310078
N-(2,6-dimethylphenyl)-4-methylsulfonylbenzamide
CID 14500553
N-(2,6-dimethylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 109061714
N-(2,6-dimethylphenyl)-4-(dimethylsulfamoyl)benzamide
CID 7719621
4-(tert-butylsulfamoyl)-N-(5-chloro-2-methylphenyl)benzamide
CID 29411178
5-(tert-butylsulfamoyl)-N-(2-ethyl-6-methylphenyl)-2-methylbenzamide
CID 26086643
3-[[4-(tert-butylsulfamoyl)benzoyl]amino]-N,N-dimethylbenzamide
CID 32627137
4-(tert-butylsulfamoyl)-N-(3-nitrophenyl)benzamide
CID 34682520
4-(tert-butylsulfamoyl)-N-(2,3-dimethylphenyl)-N-methylbenzamide
CID 55917339
3-(tert-butylsulfamoyl)-N-(2,3-dimethylphenyl)benzamide
CID 8714252
N-tert-butyl-4-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109061140

Frequently Asked Questions

What is the IUPAC name of 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide?
The IUPAC name of 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide (CID 51310180) is 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide.
What is the SMILES notation for 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide?
The canonical SMILES for 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide is Cc1cccc(C)c1NC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)cc1.
What is the InChIKey of 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide?
The InChIKey is APOLPHOHRDYQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-13-7-6-8-14(2)17(13)20-18(22)15-9-11-16(12-10-15)25(23,24)21-19(3,4)5/h6-12,21H,1-5H3,(H,20,22).
What are the key properties of 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide?
4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(tert-butylsulfamoyl)-N-(2,6-dimethylphenyl)benzamide is sourced from PubChem (CID 51310180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).