4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide

C23H24N2O3S — CID 7656072

IUPAC4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O3S/c1-25(19-9-3-4-10-19)29(27,28)20-15-13-18(14-16-20)23(26)24-22-12-6-8-17-7-2-5-11-21(17)22/h2,5-8,11-16,19H,3-4,9-10H2,1H3,(H,24,26)
InChIKeyULIQFWGIBPVHCV-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.66
Rot. Bonds5

About 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide

4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide (PubChem CID 7656072) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide
PubChem CID7656072
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide
SMILESCN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O3S/c1-25(19-9-3-4-10-19)29(27,28)20-15-13-18(14-16-20)23(26)24-22-12-6-8-17-7-2-5-11-21(17)22/h2,5-8,11-16,19H,3-4,9-10H2,1H3,(H,24,26)
InChIKeyULIQFWGIBPVHCV-UHFFFAOYSA-N
XLogP4.66
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.66
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-naphthalen-1-ylbenzamide?
The IUPAC name of 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide (CID 7656072) is 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide is CN(C1CCCC1)S(=O)(=O)c1ccc(C(=O)Nc2cccc3ccccc23)cc1.
What is the InChIKey of 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide?
The InChIKey is ULIQFWGIBPVHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-25(19-9-3-4-10-19)29(27,28)20-15-13-18(14-16-20)23(26)24-22-12-6-8-17-7-2-5-11-21(17)22/h2,5-8,11-16,19H,3-4,9-10H2,1H3,(H,24,26).
What are the key properties of 4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide?
4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide has a molecular weight of 408.52 g/mol, XLogP of 4.66, 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-naphthalen-1-ylbenzamide is sourced from PubChem (CID 7656072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).