5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

C15H24N2O3S — CID 6463060

IUPAC5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NC(C)C
InChIInChI=1S/C15H24N2O3S/c1-10(2)16-14(18)13-9-12(8-7-11(13)3)21(19,20)17-15(4,5)6/h7-10,17H,1-6H3,(H,16,18)
InChIKeyGSQXVTRYDHURQJ-UHFFFAOYSA-N
MW312.44 g/mol
LogP2.21
Rot. Bonds4

About 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (PubChem CID 6463060) has the molecular formula C15H24N2O3S and a molecular weight of 312.44 g/mol. Its IUPAC name is 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
PubChem CID6463060
Molecular FormulaC15H24N2O3S
Molecular Weight312.44 g/mol
Exact Mass312.15
IUPAC Name5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NC(C)C
InChIInChI=1S/C15H24N2O3S/c1-10(2)16-14(18)13-9-12(8-7-11(13)3)21(19,20)17-15(4,5)6/h7-10,17H,1-6H3,(H,16,18)
InChIKeyGSQXVTRYDHURQJ-UHFFFAOYSA-N
XLogP2.21
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(tert-butylsulfamoyl)-N-(1-methoxypropan-2-yl)-2-methylbenzamide
CID 51144217
5-(tert-butylsulfamoyl)-2-methyl-N-(3-methylbutyl)benzamide
CID 35515135
5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 27648413
5-(tert-butylsulfamoyl)-2-methyl-N-(2,4,6-trimethylphenyl)benzamide
CID 26085916
5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 51233854
5-(tert-butylsulfamoyl)-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-2-methylbenzamide
CID 55387703
5-(tert-butylsulfamoyl)-N-[2-(dimethylamino)-2-oxoethyl]-2-methylbenzamide
CID 31336695
5-(tert-butylsulfamoyl)-N-(2-hydroxy-4-methylphenyl)-2-methylbenzamide
CID 51166421
5-(tert-butylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-2-methylbenzamide
CID 26414248
5-(tert-butylsulfamoyl)-N-(4-cyanophenyl)-2-methylbenzamide
CID 26289902
2-bromo-5-(tert-butylsulfamoyl)-N-[(2R)-pentan-2-yl]benzamide
CID 32537367
5-(tert-butylsulfamoyl)-N-(2-ethyl-6-methylphenyl)-2-methylbenzamide
CID 26086643

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The IUPAC name of 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (CID 6463060) is 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.
What is the SMILES notation for 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The canonical SMILES for 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NC(C)C.
What is the InChIKey of 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The InChIKey is GSQXVTRYDHURQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-10(2)16-14(18)13-9-12(8-7-11(13)3)21(19,20)17-15(4,5)6/h7-10,17H,1-6H3,(H,16,18).
What are the key properties of 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide has a molecular weight of 312.44 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is sourced from PubChem (CID 6463060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).