2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide

C13H16Cl2N2O3S — CID 114551555

IUPAC2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide
SMILESCC1CCC(NC(=O)c2c(Cl)ccc(S(N)(=O)=O)c2Cl)C1
InChIInChI=1S/C13H16Cl2N2O3S/c1-7-2-3-8(6-7)17-13(18)11-9(14)4-5-10(12(11)15)21(16,19)20/h4-5,7-8H,2-3,6H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyIITQEFIGLHANCF-UHFFFAOYSA-N
MW351.26 g/mol
LogP2.56
Rot. Bonds3

About 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide

2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide (PubChem CID 114551555) has the molecular formula C13H16Cl2N2O3S and a molecular weight of 351.26 g/mol. Its IUPAC name is 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide
PubChem CID114551555
Molecular FormulaC13H16Cl2N2O3S
Molecular Weight351.26 g/mol
Exact Mass350.03
IUPAC Name2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide
SMILESCC1CCC(NC(=O)c2c(Cl)ccc(S(N)(=O)=O)c2Cl)C1
InChIInChI=1S/C13H16Cl2N2O3S/c1-7-2-3-8(6-7)17-13(18)11-9(14)4-5-10(12(11)15)21(16,19)20/h4-5,7-8H,2-3,6H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyIITQEFIGLHANCF-UHFFFAOYSA-N
XLogP2.56
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.26
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide 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

2,4-dichloro-3-[(3-methylcyclopentyl)carbamoyl]benzenesulfonyl chloride
CID 114551487
2,3,6-trichloro-N-cyclopropyl-5-sulfamoylbenzamide
CID 65375569
5-chloro-2-methyl-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide
CID 114551529
2,4-dichloro-3-(cyclohexylcarbamoyl)benzenesulfonyl chloride
CID 65366806
3-bromo-4-chloro-N-(3-methylcyclopentyl)benzamide
CID 107989487
3-chloro-N-(3-methylcyclopentyl)-5-sulfamoylbenzamide
CID 114549394
6-amino-3-chloro-N-(3-methylcyclopentyl)pyridine-2-carboxamide
CID 114540527
2-amino-3-chloro-N-(3-methylcyclopentyl)benzamide
CID 114542613
2,6-dichloro-N-(3-methylcyclopentyl)pyridine-4-carboxamide
CID 114545578
3-chloro-2-fluoro-N-(3-methylcyclopentyl)benzamide
CID 114550116
2,6-dichloro-N-(2,2-difluoroethyl)-3-sulfamoylbenzamide
CID 115408900
3-chloro-N-(3-methylcyclopentyl)benzamide
CID 114549458

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide?
The IUPAC name of 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide (CID 114551555) is 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide.
What is the SMILES notation for 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide?
The canonical SMILES for 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide is CC1CCC(NC(=O)c2c(Cl)ccc(S(N)(=O)=O)c2Cl)C1.
What is the InChIKey of 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide?
The InChIKey is IITQEFIGLHANCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16Cl2N2O3S/c1-7-2-3-8(6-7)17-13(18)11-9(14)4-5-10(12(11)15)21(16,19)20/h4-5,7-8H,2-3,6H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide?
2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide has a molecular weight of 351.26 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(3-methylcyclopentyl)-3-sulfamoylbenzamide is sourced from PubChem (CID 114551555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).