4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide

C20H26N2O3S — CID 109057880

IUPAC4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-14-21-20(23)18-10-12-19(13-11-18)26(24,25)22(16(2)3)15-17-8-6-5-7-9-17/h5-13,16H,4,14-15H2,1-3H3,(H,21,23)
InChIKeyZSNLZEABOVZOOG-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.43
Rot. Bonds8

About 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide

4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide (PubChem CID 109057880) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide.

Molecular Properties

Compound Name4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide
PubChem CID109057880
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide
SMILESCCCNC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-14-21-20(23)18-10-12-19(13-11-18)26(24,25)22(16(2)3)15-17-8-6-5-7-9-17/h5-13,16H,4,14-15H2,1-3H3,(H,21,23)
InChIKeyZSNLZEABOVZOOG-UHFFFAOYSA-N
XLogP3.43
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[benzyl(propan-2-yl)sulfamoyl]-N-(2-methylphenyl)benzamide
CID 7189729
4-[[N-(benzenesulfonyl)anilino]methyl]-N-propylbenzamide
CID 4239264
4-[methyl(phenyl)sulfamoyl]-N-propylbenzamide
CID 2432115
4-[benzyl(propan-2-yl)sulfamoyl]-N-naphthalen-1-ylbenzamide
CID 16833704
N-benzyl-N-propan-2-ylbenzenesulfonamide
CID 2813484
4-[benzyl(propan-2-yl)sulfamoyl]-N-(3-chlorophenyl)benzamide
CID 16833688
4-[benzyl(propan-2-yl)sulfamoyl]-N-(6-methyl-2-pyridinyl)benzamide
CID 7153842
4-[ethyl(phenyl)sulfamoyl]-N-(2-phenylethyl)benzamide
CID 4797803
ethyl 2-[[4-[benzyl(propan-2-yl)sulfamoyl]benzoyl]amino]-4,5-dimethylthiophene-3-carboxylate
CID 16833611
4-[[(4-chlorophenyl)sulfonyl-(1-phenylpropyl)amino]methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 67117642
2-[benzyl(propan-2-yl)amino]-N-propylpyrimidine-5-carboxamide
CID 109246544
4-[benzyl(propan-2-yl)sulfamoyl]-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 43947050

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide?
The IUPAC name of 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide (CID 109057880) is 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide.
What is the SMILES notation for 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide?
The canonical SMILES for 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide is CCCNC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1.
What is the InChIKey of 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide?
The InChIKey is ZSNLZEABOVZOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-4-14-21-20(23)18-10-12-19(13-11-18)26(24,25)22(16(2)3)15-17-8-6-5-7-9-17/h5-13,16H,4,14-15H2,1-3H3,(H,21,23).
What are the key properties of 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide?
4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide has a molecular weight of 374.51 g/mol, XLogP of 3.43, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(propan-2-yl)sulfamoyl]-N-propylbenzamide is sourced from PubChem (CID 109057880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).