3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide

C19H24N2O3S — CID 17226677

IUPAC3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide
SMILESCCCCNS(=O)(=O)c1cccc(C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C19H24N2O3S/c1-4-5-11-20-25(23,24)17-8-6-7-16(13-17)19(22)21-18-12-14(2)9-10-15(18)3/h6-10,12-13,20H,4-5,11H2,1-3H3,(H,21,22)
InChIKeyMINDOBXLIRANJR-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.63
Rot. Bonds7

About 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide

3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide (PubChem CID 17226677) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide.

Molecular Properties

Compound Name3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide
PubChem CID17226677
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide
SMILESCCCCNS(=O)(=O)c1cccc(C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C19H24N2O3S/c1-4-5-11-20-25(23,24)17-8-6-7-16(13-17)19(22)21-18-12-14(2)9-10-15(18)3/h6-10,12-13,20H,4-5,11H2,1-3H3,(H,21,22)
InChIKeyMINDOBXLIRANJR-UHFFFAOYSA-N
XLogP3.63
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromophenyl)-3-(butylsulfamoyl)benzamide
CID 17226776
N-butyl-3-[(2,5-dimethylphenyl)sulfamoyl]benzamide
CID 109062590
N-(4-chloro-2-methylphenyl)-3-(pentylsulfamoyl)benzamide
CID 109065381
N-(2,4-dimethylphenyl)-3-(ethylsulfamoyl)benzamide
CID 26538648
N-butyl-2-[[3-(butylsulfamoyl)benzoyl]amino]benzamide
CID 17226854
3-(ethylsulfamoyl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26698365
3-(butylsulfamoyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 17226764
N-(2,6-dimethylphenyl)-3-(propylsulfamoyl)benzamide
CID 109061918
N-(3-chloro-4-methylphenyl)-3-(pentylsulfamoyl)benzamide
CID 109065382
N-(2-methoxyphenyl)-3-(pentylsulfamoyl)benzamide
CID 109065384
N-(4-fluoro-2-methylphenyl)-3-(propylsulfamoyl)benzamide
CID 4789120
N-(3,5-dimethylphenyl)-3-(propylsulfamoyl)benzamide
CID 109061917

Frequently Asked Questions

What is the IUPAC name of 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide?
The IUPAC name of 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide (CID 17226677) is 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide.
What is the SMILES notation for 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide?
The canonical SMILES for 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide is CCCCNS(=O)(=O)c1cccc(C(=O)Nc2cc(C)ccc2C)c1.
What is the InChIKey of 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide?
The InChIKey is MINDOBXLIRANJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-4-5-11-20-25(23,24)17-8-6-7-16(13-17)19(22)21-18-12-14(2)9-10-15(18)3/h6-10,12-13,20H,4-5,11H2,1-3H3,(H,21,22).
What are the key properties of 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide?
3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.63, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide is sourced from PubChem (CID 17226677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).