N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide

C18H22N2O3S — CID 26538375

IUPACN-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1C
InChIInChI=1S/C18H22N2O3S/c1-12(2)20-24(22,23)16-9-6-8-15(11-16)18(21)19-17-10-5-7-13(3)14(17)4/h5-12,20H,1-4H3,(H,19,21)
InChIKeyURYLOOMAEXBQHW-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.24
Rot. Bonds5

About N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide

N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide (PubChem CID 26538375) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
PubChem CID26538375
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC NameN-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
SMILESCc1cccc(NC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1C
InChIInChI=1S/C18H22N2O3S/c1-12(2)20-24(22,23)16-9-6-8-15(11-16)18(21)19-17-10-5-7-13(3)14(17)4/h5-12,20H,1-4H3,(H,19,21)
InChIKeyURYLOOMAEXBQHW-UHFFFAOYSA-N
XLogP3.24
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-propan-2-ylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 17438081
3-(tert-butylsulfamoyl)-N-(2,3-dimethylphenyl)benzamide
CID 8714252
N-(2-methylsulfanylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 46689087
N-(2-cyanophenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 109062122
3-(cyclopropylsulfamoyl)-N-(2,3-dimethylphenyl)benzamide
CID 30856229
N-(2-methylphenyl)-3-(1-phenylethylsulfamoyl)benzamide
CID 109064636
1-N-(2,3-dimethylphenyl)-3-N-propan-2-ylbenzene-1,3-dicarboxamide
CID 109050570
N-[2-(2-amino-2-oxoethyl)phenyl]-3-(propan-2-ylsulfamoyl)benzamide
CID 55672416
N-(4-acetamidophenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 26499556
3-(propan-2-ylsulfamoyl)-N-quinolin-8-ylbenzamide
CID 31309454
N-ethyl-2-[[3-(propan-2-ylsulfamoyl)benzoyl]amino]benzamide
CID 35304004
3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 109062826

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide (CID 26538375) is N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide is Cc1cccc(NC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide?
The InChIKey is URYLOOMAEXBQHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-12(2)20-24(22,23)16-9-6-8-15(11-16)18(21)19-17-10-5-7-13(3)14(17)4/h5-12,20H,1-4H3,(H,19,21).
What are the key properties of N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide?
N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide has a molecular weight of 346.45 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 26538375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).