4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide

C20H24N2O3S — CID 109058403

IUPAC4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C20H24N2O3S/c1-13(2)18-6-4-5-14(3)19(18)21-20(23)15-7-11-17(12-8-15)26(24,25)22-16-9-10-16/h4-8,11-13,16,22H,9-10H2,1-3H3,(H,21,23)
InChIKeySUIKOHMYNMENEB-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.81
Rot. Bonds6

About 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide

4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide (PubChem CID 109058403) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
PubChem CID109058403
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC Name4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C20H24N2O3S/c1-13(2)18-6-4-5-14(3)19(18)21-20(23)15-7-11-17(12-8-15)26(24,25)22-16-9-10-16/h4-8,11-13,16,22H,9-10H2,1-3H3,(H,21,23)
InChIKeySUIKOHMYNMENEB-UHFFFAOYSA-N
XLogP3.81
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
CID 109058401
4-(tert-butylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 46689119
N-(2-methyl-6-propan-2-ylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 2701412
N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
CID 40819169
4-(cyclopropylsulfamoyl)-N-(3-methyl-2-pyridinyl)benzamide
CID 27544592
N-tert-butyl-4-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109061140
4-cyclopentyloxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 39885058
N-cyclopropyl-4-[(2,6-dimethylphenyl)sulfamoyl]benzamide
CID 109058325
3-chloro-4-[(4-methylphenyl)sulfonylamino]-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 38015649
4-(cyclopropylsulfamoyl)-N-(2-methylsulfanylphenyl)benzamide
CID 46533931
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
[1-(2-methyl-6-propan-2-ylanilino)-1-oxopropan-2-yl] 4-(methylsulfamoyl)benzoate
CID 46535437

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide (CID 109058403) is 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide is Cc1cccc(C(C)C)c1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The InChIKey is SUIKOHMYNMENEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-13(2)18-6-4-5-14(3)19(18)21-20(23)15-7-11-17(12-8-15)26(24,25)22-16-9-10-16/h4-8,11-13,16,22H,9-10H2,1-3H3,(H,21,23).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide has a molecular weight of 372.49 g/mol, XLogP of 3.81, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 109058403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).