N-(4-cyanocyclohexyl)pyridine-3-sulfonamide

C12H15N3O2S — CID 116816994

IUPACN-(4-cyanocyclohexyl)pyridine-3-sulfonamide
SMILESN#CC1CCC(NS(=O)(=O)c2cccnc2)CC1
InChIInChI=1S/C12H15N3O2S/c13-8-10-3-5-11(6-4-10)15-18(16,17)12-2-1-7-14-9-12/h1-2,7,9-11,15H,3-6H2
InChIKeyFPBCOGMTIBXTCV-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.44
Rot. Bonds3

About N-(4-cyanocyclohexyl)pyridine-3-sulfonamide

N-(4-cyanocyclohexyl)pyridine-3-sulfonamide (PubChem CID 116816994) has the molecular formula C12H15N3O2S and a molecular weight of 265.34 g/mol. Its IUPAC name is N-(4-cyanocyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-cyanocyclohexyl)pyridine-3-sulfonamide
PubChem CID116816994
Molecular FormulaC12H15N3O2S
Molecular Weight265.34 g/mol
Exact Mass265.09
IUPAC NameN-(4-cyanocyclohexyl)pyridine-3-sulfonamide
SMILESN#CC1CCC(NS(=O)(=O)c2cccnc2)CC1
InChIInChI=1S/C12H15N3O2S/c13-8-10-3-5-11(6-4-10)15-18(16,17)12-2-1-7-14-9-12/h1-2,7,9-11,15H,3-6H2
InChIKeyFPBCOGMTIBXTCV-UHFFFAOYSA-N
XLogP1.44
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylate
CID 115617333
N-(3-aminocyclobutyl)pyridine-3-sulfonamide
CID 43597835
N-pyrrolidin-3-ylpyridine-3-sulfonamide
CID 62380285
N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 47331340
N-(6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 63662802
N-(4-tert-butyl-4-propan-2-ylcyclohexyl)pyridine-3-sulfonamide
CID 130233502
3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962
pyridin-3-yl 3-(cyclopropylsulfamoyl)benzenesulfonate
CID 75453084
N-(2-methyl-3-oxo-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl)pyridine-3-sulfonamide
CID 91910836
N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 131898317
N-(2-aminocyclopentyl)pyridine-3-sulfonamide
CID 63252124
N-(1-methyl-3,4-dihydro-2H-quinolin-3-yl)pyridine-3-sulfonamide
CID 126835110

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanocyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of N-(4-cyanocyclohexyl)pyridine-3-sulfonamide (CID 116816994) is N-(4-cyanocyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(4-cyanocyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(4-cyanocyclohexyl)pyridine-3-sulfonamide is N#CC1CCC(NS(=O)(=O)c2cccnc2)CC1.
What is the InChIKey of N-(4-cyanocyclohexyl)pyridine-3-sulfonamide?
The InChIKey is FPBCOGMTIBXTCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S/c13-8-10-3-5-11(6-4-10)15-18(16,17)12-2-1-7-14-9-12/h1-2,7,9-11,15H,3-6H2.
What are the key properties of N-(4-cyanocyclohexyl)pyridine-3-sulfonamide?
N-(4-cyanocyclohexyl)pyridine-3-sulfonamide has a molecular weight of 265.34 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanocyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 116816994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).