4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide

C18H22N2O3S — CID 17108469

IUPAC4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(CC)cc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-3-13-19-24(22,23)17-11-9-16(10-12-17)20-18(21)15-7-5-14(4-2)6-8-15/h5-12,19H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyLQGDKVSSGGQRGB-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.19
Rot. Bonds7

About 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide

4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide (PubChem CID 17108469) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
PubChem CID17108469
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(CC)cc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-3-13-19-24(22,23)17-11-9-16(10-12-17)20-18(21)15-7-5-14(4-2)6-8-15/h5-12,19H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyLQGDKVSSGGQRGB-UHFFFAOYSA-N
XLogP3.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(dimethylamino)propylsulfamoyl]-N-(4-ethylphenyl)benzamide
CID 109060317
N-(4-ethylphenyl)-4-(2-methylpropylsulfamoyl)benzamide
CID 109058950
4-heptoxy-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4950690
2-(4-ethylphenoxy)-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 4932605
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-4-ethylbenzamide
CID 55865615
N-(2-ethylphenyl)-4-(propylsulfamoyl)benzamide
CID 109058046
4-(cyclopentylsulfamoyl)-N-(4-ethylphenyl)benzamide
CID 109059369
4-(ethylsulfamoyl)-N-(4-methylphenyl)benzamide
CID 9411634
4-(butylsulfamoyl)-N-(4-cyanophenyl)benzamide
CID 109058795
N-[4-(ethylsulfamoyl)phenyl]-4-[(2-phenylacetyl)amino]benzamide
CID 17119617
2,4-dimethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 38352261
4-chloro-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 4932898

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide?
The IUPAC name of 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide (CID 17108469) is 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide is CCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(CC)cc2)cc1.
What is the InChIKey of 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide?
The InChIKey is LQGDKVSSGGQRGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-3-13-19-24(22,23)17-11-9-16(10-12-17)20-18(21)15-7-5-14(4-2)6-8-15/h5-12,19H,3-4,13H2,1-2H3,(H,20,21).
What are the key properties of 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide?
4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide has a molecular weight of 346.45 g/mol, XLogP of 3.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 17108469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).