N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide

C12H14Cl2N2O3S — CID 43246828

IUPACN-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide
SMILESNS(=O)(=O)c1cc(Cl)c(NC(=O)C2CCCC2)c(Cl)c1
InChIInChI=1S/C12H14Cl2N2O3S/c13-9-5-8(20(15,18)19)6-10(14)11(9)16-12(17)7-3-1-2-4-7/h5-7H,1-4H2,(H,16,17)(H2,15,18,19)
InChIKeyIBHJRSVFDUQPEL-UHFFFAOYSA-N
MW337.23 g/mol
LogP2.77
Rot. Bonds3

About N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide

N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide (PubChem CID 43246828) has the molecular formula C12H14Cl2N2O3S and a molecular weight of 337.23 g/mol. Its IUPAC name is N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide
PubChem CID43246828
Molecular FormulaC12H14Cl2N2O3S
Molecular Weight337.23 g/mol
Exact Mass336.01
IUPAC NameN-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide
SMILESNS(=O)(=O)c1cc(Cl)c(NC(=O)C2CCCC2)c(Cl)c1
InChIInChI=1S/C12H14Cl2N2O3S/c13-9-5-8(20(15,18)19)6-10(14)11(9)16-12(17)7-3-1-2-4-7/h5-7H,1-4H2,(H,16,17)(H2,15,18,19)
InChIKeyIBHJRSVFDUQPEL-UHFFFAOYSA-N
XLogP2.77
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.23
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-6-methyl-4-sulfamoylphenyl)cyclobutanecarboxamide
CID 66255370
N-(2,6-dimethyl-4-sulfamoylphenyl)cyclohexanecarboxamide
CID 43134141
N-(2,6-diethyl-4-sulfamoylphenyl)cyclobutanecarboxamide
CID 43134132
N-(2-chloro-5-sulfamoylphenyl)cyclobutanecarboxamide
CID 61131077
N-(2,6-dichlorophenyl)cyclohexanecarboxamide
CID 897145
N-(3-sulfamoylphenyl)cycloheptanecarboxamide
CID 62590757
N-(4-amino-2-chloro-6-methylphenyl)cyclohexanecarboxamide
CID 100828283
N-(2,6-dichloro-4-sulfamoylphenyl)-2-(oxolan-2-yl)acetamide
CID 65155701
N-(2,6-dichloro-4-fluorophenyl)cyclopropanecarboxamide
CID 82889777
N-(2-fluoro-5-sulfamoylphenyl)cyclopentanecarboxamide
CID 61129788
3-amino-N-(2,4,6-trichlorophenyl)cyclohexane-1-carboxamide
CID 63042160
N-(2-ethyl-6-methyl-4-sulfamoylphenyl)cyclopropanecarboxamide
CID 43246565

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide (CID 43246828) is N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide is NS(=O)(=O)c1cc(Cl)c(NC(=O)C2CCCC2)c(Cl)c1.
What is the InChIKey of N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide?
The InChIKey is IBHJRSVFDUQPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O3S/c13-9-5-8(20(15,18)19)6-10(14)11(9)16-12(17)7-3-1-2-4-7/h5-7H,1-4H2,(H,16,17)(H2,15,18,19).
What are the key properties of N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide?
N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide has a molecular weight of 337.23 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-4-sulfamoylphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 43246828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).