3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide

C19H24N2O3S — CID 109062826

IUPAC3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
SMILESCc1cccc(NS(=O)(=O)c2cccc(C(=O)NCC(C)C)c2)c1C
InChIInChI=1S/C19H24N2O3S/c1-13(2)12-20-19(22)16-8-6-9-17(11-16)25(23,24)21-18-10-5-7-14(3)15(18)4/h5-11,13,21H,12H2,1-4H3,(H,20,22)
InChIKeyFWKDOVQZGZGMCG-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.49
Rot. Bonds6

About 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide

3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide (PubChem CID 109062826) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
PubChem CID109062826
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
SMILESCc1cccc(NS(=O)(=O)c2cccc(C(=O)NCC(C)C)c2)c1C
InChIInChI=1S/C19H24N2O3S/c1-13(2)12-20-19(22)16-8-6-9-17(11-16)25(23,24)21-18-10-5-7-14(3)15(18)4/h5-11,13,21H,12H2,1-4H3,(H,20,22)
InChIKeyFWKDOVQZGZGMCG-UHFFFAOYSA-N
XLogP3.49
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109062830
N-butan-2-yl-3-[(2,3-dimethylphenyl)sulfamoyl]benzamide
CID 109063059
4-chloro-3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 5035675
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765
N-[2-(dimethylamino)ethyl]-3-[(2,3-dimethylphenyl)sulfamoyl]benzamide
CID 109064098
N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 26538375
N-(2-methylphenyl)-3-(2-methylpropylsulfamoyl)benzamide
CID 109062702
3-[(2-chlorophenyl)sulfamoyl]-N-[(2S)-2-hydroxy-3-methylbutyl]benzamide
CID 97012345
5-N-(2,3-dimethylphenyl)-3-N-(2-methylpropyl)pyridine-3,5-dicarboxamide
CID 109102194
3-[(4-fluorophenyl)methylsulfamoyl]-N-(2-methylpropyl)benzamide
CID 109062787
N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109063672
N-[(2R)-2-(ethylamino)propyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 120653897

Frequently Asked Questions

What is the IUPAC name of 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide?
The IUPAC name of 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide (CID 109062826) is 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide is Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NCC(C)C)c2)c1C.
What is the InChIKey of 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide?
The InChIKey is FWKDOVQZGZGMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-13(2)12-20-19(22)16-8-6-9-17(11-16)25(23,24)21-18-10-5-7-14(3)15(18)4/h5-11,13,21H,12H2,1-4H3,(H,20,22).
What are the key properties of 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide?
3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 109062826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).