N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide

C14H20N2O3S — CID 9141368

IUPACN-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide
SMILESCc1cc(S(N)(=O)=O)cc(NC(=O)C2CCCC2)c1C
InChIInChI=1S/C14H20N2O3S/c1-9-7-12(20(15,18)19)8-13(10(9)2)16-14(17)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyZIEVMNKWQJAQAT-UHFFFAOYSA-N
MW296.39 g/mol
LogP2.08
Rot. Bonds3

About N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide

N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide (PubChem CID 9141368) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide
PubChem CID9141368
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide
SMILESCc1cc(S(N)(=O)=O)cc(NC(=O)C2CCCC2)c1C
InChIInChI=1S/C14H20N2O3S/c1-9-7-12(20(15,18)19)8-13(10(9)2)16-14(17)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyZIEVMNKWQJAQAT-UHFFFAOYSA-N
XLogP2.08
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide (CID 9141368) is N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide is Cc1cc(S(N)(=O)=O)cc(NC(=O)C2CCCC2)c1C.
What is the InChIKey of N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide?
The InChIKey is ZIEVMNKWQJAQAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-9-7-12(20(15,18)19)8-13(10(9)2)16-14(17)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19).
What are the key properties of N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide?
N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide has a molecular weight of 296.39 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethyl-5-sulfamoylphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 9141368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).