3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide

C19H24N2O4S — CID 17480198

IUPAC3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NCCC(C)C)c2)cc1
InChIInChI=1S/C19H24N2O4S/c1-14(2)11-12-20-19(22)15-5-4-6-18(13-15)26(23,24)21-16-7-9-17(25-3)10-8-16/h4-10,13-14,21H,11-12H2,1-3H3,(H,20,22)
InChIKeyHDOXZFROSATOFY-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.27
Rot. Bonds8

About 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide

3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide (PubChem CID 17480198) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
PubChem CID17480198
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NCCC(C)C)c2)cc1
InChIInChI=1S/C19H24N2O4S/c1-14(2)11-12-20-19(22)15-5-4-6-18(13-15)26(23,24)21-16-7-9-17(25-3)10-8-16/h4-10,13-14,21H,11-12H2,1-3H3,(H,20,22)
InChIKeyHDOXZFROSATOFY-UHFFFAOYSA-N
XLogP3.27
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylbutyl)-3-[(4-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109065328
3-[(4-acetylphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
CID 109065339
3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methoxypropyl)benzamide
CID 26593268
methyl 4-[[3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]butanoate
CID 18109757
3-[(4-methoxyphenyl)sulfamoyl]-N-(2-phenylethyl)benzamide
CID 18108709
N-[(4-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 18158891
3-[(3-fluorophenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
CID 109065341
N-(3-aminobutyl)-3-[(4-ethoxyphenyl)sulfamoyl]benzamide;hydrochloride
CID 119498833
N-methoxy-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 17421680
N-tert-butyl-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 51210790
1-(2-chloroethyl)-3-[[3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]urea
CID 2327322
N-[(3-chlorophenyl)methyl]-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 18291284

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide?
The IUPAC name of 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide (CID 17480198) is 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide.
What is the SMILES notation for 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide?
The canonical SMILES for 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide is COc1ccc(NS(=O)(=O)c2cccc(C(=O)NCCC(C)C)c2)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide?
The InChIKey is HDOXZFROSATOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14(2)11-12-20-19(22)15-5-4-6-18(13-15)26(23,24)21-16-7-9-17(25-3)10-8-16/h4-10,13-14,21H,11-12H2,1-3H3,(H,20,22).
What are the key properties of 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide?
3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide has a molecular weight of 376.48 g/mol, XLogP of 3.27, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide is sourced from PubChem (CID 17480198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).