4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide

C19H22N2O3S — CID 7656046

IUPAC4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3S/c1-21(17-9-5-6-10-17)25(23,24)18-13-11-15(12-14-18)19(22)20-16-7-3-2-4-8-16/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,20,22)
InChIKeyUWRJQWVDVLZYBK-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.50
Rot. Bonds5

About 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide

4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide (PubChem CID 7656046) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
PubChem CID7656046
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3S/c1-21(17-9-5-6-10-17)25(23,24)18-13-11-15(12-14-18)19(22)20-16-7-3-2-4-8-16/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,20,22)
InChIKeyUWRJQWVDVLZYBK-UHFFFAOYSA-N
XLogP3.50
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide?
The IUPAC name of 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide (CID 7656046) is 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide is CN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2)cc1.
What is the InChIKey of 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide?
The InChIKey is UWRJQWVDVLZYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-21(17-9-5-6-10-17)25(23,24)18-13-11-15(12-14-18)19(22)20-16-7-3-2-4-8-16/h2-4,7-8,11-14,17H,5-6,9-10H2,1H3,(H,20,22).
What are the key properties of 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide?
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide has a molecular weight of 358.46 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 7656046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).