N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide

C16H26N2O3S — CID 51320644

IUPACN-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCCC(C)(C)NC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1
InChIInChI=1S/C16H26N2O3S/c1-7-16(4,5)17-15(19)13-8-10-14(11-9-13)22(20,21)18(6)12(2)3/h8-12H,7H2,1-6H3,(H,17,19)
InChIKeyQADHGXCBPSOZKZ-UHFFFAOYSA-N
MW326.46 g/mol
LogP2.63
Rot. Bonds6

About N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide

N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide (PubChem CID 51320644) has the molecular formula C16H26N2O3S and a molecular weight of 326.46 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
PubChem CID51320644
Molecular FormulaC16H26N2O3S
Molecular Weight326.46 g/mol
Exact Mass326.17
IUPAC NameN-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
SMILESCCC(C)(C)NC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1
InChIInChI=1S/C16H26N2O3S/c1-7-16(4,5)17-15(19)13-8-10-14(11-9-13)22(20,21)18(6)12(2)3/h8-12H,7H2,1-6H3,(H,17,19)
InChIKeyQADHGXCBPSOZKZ-UHFFFAOYSA-N
XLogP2.63
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.46
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dimethylsulfamoyl)-N-(2,4,4-trimethylpentan-2-yl)benzamide
CID 51188883
N-(2-methoxyethyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 51297875
3-methyl-2-[[4-[methyl(propan-2-yl)sulfamoyl]benzoyl]amino]butanoic acid
CID 119170436
N-(4-methylpentyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 33076936
N-(2-methylbutan-2-yl)-4-propan-2-yloxybenzamide
CID 56920644
4-[[[4-[methyl(propan-2-yl)sulfamoyl]phenyl]methylamino]methyl]benzoic acid
CID 122030686
N-[2-(2-methoxyethoxy)ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55685287
4-[(4-chlorophenyl)sulfonylamino]-N-(2-methylbutan-2-yl)benzamide
CID 94621798
4-[[(2S)-2-[(4-chlorophenyl)sulfonylamino]propanoyl]amino]-N-(2-methylbutan-2-yl)benzamide
CID 55990856
N-(4-tert-butyl-1,3-thiazol-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993057
N-[1-(4-ethoxyphenyl)ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55490961
N-(3,5-dichlorophenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993166

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The IUPAC name of N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide (CID 51320644) is N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide is CCC(C)(C)NC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1.
What is the InChIKey of N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
The InChIKey is QADHGXCBPSOZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3S/c1-7-16(4,5)17-15(19)13-8-10-14(11-9-13)22(20,21)18(6)12(2)3/h8-12H,7H2,1-6H3,(H,17,19).
What are the key properties of N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide?
N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide has a molecular weight of 326.46 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide is sourced from PubChem (CID 51320644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).