N-pyridin-4-ylsulfonylcyclohexanecarboxamide

C12H16N2O3S — CID 71911683

IUPACN-pyridin-4-ylsulfonylcyclohexanecarboxamide
SMILESO=C(NS(=O)(=O)c1ccncc1)C1CCCCC1
InChIInChI=1S/C12H16N2O3S/c15-12(10-4-2-1-3-5-10)14-18(16,17)11-6-8-13-9-7-11/h6-10H,1-5H2,(H,14,15)
InChIKeyRFFZXEINCZJOGR-UHFFFAOYSA-N
MW268.34 g/mol
LogP1.47
Rot. Bonds3

About N-pyridin-4-ylsulfonylcyclohexanecarboxamide

N-pyridin-4-ylsulfonylcyclohexanecarboxamide (PubChem CID 71911683) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-pyridin-4-ylsulfonylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-pyridin-4-ylsulfonylcyclohexanecarboxamide
PubChem CID71911683
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC NameN-pyridin-4-ylsulfonylcyclohexanecarboxamide
SMILESO=C(NS(=O)(=O)c1ccncc1)C1CCCCC1
InChIInChI=1S/C12H16N2O3S/c15-12(10-4-2-1-3-5-10)14-18(16,17)11-6-8-13-9-7-11/h6-10H,1-5H2,(H,14,15)
InChIKeyRFFZXEINCZJOGR-UHFFFAOYSA-N
XLogP1.47
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(benzenesulfonyl)-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 166232544
N-[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfonylcyclohexanecarboxamide
CID 1350854
N-(4-methylphenyl)sulfonylcyclopropanecarboxamide
CID 46179849
cyano-[4-(cyclohexanecarbonylsulfamoyl)phenyl]imino-oxidoazanium
CID 173312760
(3S)-N-(benzenesulfonyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 94185832
N'-(cyclohexanecarbonyl)pyridine-4-carbohydrazide
CID 782647
(3R)-1-(cyclopropanecarbonyl)-N-pyridin-3-ylsulfonylpiperidine-3-carboxamide
CID 95311721
N-[(2R)-1-oxo-1-(pyridin-3-ylsulfonylamino)propan-2-yl]cyclohexanecarboxamide
CID 97065422
N'-(4-chlorophenyl)sulfonylcyclohexanecarbohydrazide
CID 695770
N-sulfamoylcyclohexanecarboxamide
CID 85138714
N-[4-(3-methylbutanoylsulfamoyl)phenyl]cyclohexanecarboxamide
CID 1116699
N-[(2R)-1-[(4-acetylphenyl)sulfonylamino]-1-oxopropan-2-yl]cyclohexanecarboxamide
CID 97195810

Frequently Asked Questions

What is the IUPAC name of N-pyridin-4-ylsulfonylcyclohexanecarboxamide?
The IUPAC name of N-pyridin-4-ylsulfonylcyclohexanecarboxamide (CID 71911683) is N-pyridin-4-ylsulfonylcyclohexanecarboxamide.
What is the SMILES notation for N-pyridin-4-ylsulfonylcyclohexanecarboxamide?
The canonical SMILES for N-pyridin-4-ylsulfonylcyclohexanecarboxamide is O=C(NS(=O)(=O)c1ccncc1)C1CCCCC1.
What is the InChIKey of N-pyridin-4-ylsulfonylcyclohexanecarboxamide?
The InChIKey is RFFZXEINCZJOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c15-12(10-4-2-1-3-5-10)14-18(16,17)11-6-8-13-9-7-11/h6-10H,1-5H2,(H,14,15).
What are the key properties of N-pyridin-4-ylsulfonylcyclohexanecarboxamide?
N-pyridin-4-ylsulfonylcyclohexanecarboxamide has a molecular weight of 268.34 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-4-ylsulfonylcyclohexanecarboxamide is sourced from PubChem (CID 71911683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).