4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide

C19H24N2O3S — CID 109061330

IUPAC4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide
SMILESCCCCCNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-3-4-5-13-20-19(22)16-9-11-18(12-10-16)25(23,24)21-17-8-6-7-15(2)14-17/h6-12,14,21H,3-5,13H2,1-2H3,(H,20,22)
InChIKeyMCBGOOBLGZNCHV-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.72
Rot. Bonds8

About 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide

4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide (PubChem CID 109061330) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide.

Molecular Properties

Compound Name4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide
PubChem CID109061330
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide
SMILESCCCCCNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C19H24N2O3S/c1-3-4-5-13-20-19(22)16-9-11-18(12-10-16)25(23,24)21-17-8-6-7-15(2)14-17/h6-12,14,21H,3-5,13H2,1-2H3,(H,20,22)
InChIKeyMCBGOOBLGZNCHV-UHFFFAOYSA-N
XLogP3.72
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide 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-hexyl-4-(phenylsulfamoyl)benzamide
CID 32646547
N-butyl-4-(phenylsulfamoyl)benzamide
CID 18106255
4-[(2,4-dimethylphenyl)sulfamoyl]-N-pentylbenzamide
CID 109061332
3-[(3,4-dichlorophenyl)sulfonylamino]-N-pentylbenzamide
CID 7908049
N-(2-benzamidoethyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 38202600
3-[(3-acetylphenyl)sulfamoyl]-N-pentylbenzamide
CID 109065428
N-(3-ethoxypropyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 26776167
4-[(3,4-dichlorophenyl)sulfonylamino]-N-pentylbenzamide
CID 18279871
N-(4-methylpentyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 32628667
4-(methylsulfamoyl)-N-nonylbenzamide
CID 46549901
N-butyl-4-(pentylsulfamoyl)benzamide
CID 109058608
N-propyl-4-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 26823127

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide?
The IUPAC name of 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide (CID 109061330) is 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide.
What is the SMILES notation for 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide?
The canonical SMILES for 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide is CCCCCNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1.
What is the InChIKey of 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide?
The InChIKey is MCBGOOBLGZNCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-3-4-5-13-20-19(22)16-9-11-18(12-10-16)25(23,24)21-17-8-6-7-15(2)14-17/h6-12,14,21H,3-5,13H2,1-2H3,(H,20,22).
What are the key properties of 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide?
4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide has a molecular weight of 360.48 g/mol, XLogP of 3.72, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methylphenyl)sulfamoyl]-N-pentylbenzamide is sourced from PubChem (CID 109061330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).