N-(3-methylcyclohexyl)pyridine-3-sulfonamide

C12H18N2O2S — CID 47331340

IUPACN-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C12H18N2O2S/c1-10-4-2-5-11(8-10)14-17(15,16)12-6-3-7-13-9-12/h3,6-7,9-11,14H,2,4-5,8H2,1H3
InChIKeyGXXUOUKUQITCCO-UHFFFAOYSA-N
MW254.35 g/mol
LogP1.94
Rot. Bonds3

About N-(3-methylcyclohexyl)pyridine-3-sulfonamide

N-(3-methylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 47331340) has the molecular formula C12H18N2O2S and a molecular weight of 254.35 g/mol. Its IUPAC name is N-(3-methylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3-methylcyclohexyl)pyridine-3-sulfonamide
PubChem CID47331340
Molecular FormulaC12H18N2O2S
Molecular Weight254.35 g/mol
Exact Mass254.11
IUPAC NameN-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(NS(=O)(=O)c2cccnc2)C1
InChIInChI=1S/C12H18N2O2S/c1-10-4-2-5-11(8-10)14-17(15,16)12-6-3-7-13-9-12/h3,6-7,9-11,14H,2,4-5,8H2,1H3
InChIKeyGXXUOUKUQITCCO-UHFFFAOYSA-N
XLogP1.94
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962
3-[(3-methylcyclohexyl)sulfamoyl]benzenesulfonyl fluoride
CID 114958166
N-(3-aminocyclobutyl)pyridine-3-sulfonamide
CID 43597835
6-cyano-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 115602590
2-hydrazinyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 43456995
N-pyrrolidin-3-ylpyridine-3-sulfonamide
CID 62380285
N-(2-aminocyclopentyl)pyridine-3-sulfonamide
CID 63252124
N-(4-cyanocyclohexyl)pyridine-3-sulfonamide
CID 116816994
methyl 4-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylate
CID 115617333
5-amino-N-(3-methylcyclohexyl)-1H-pyrazole-4-sulfonamide
CID 60809111
N-(6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 63662802
N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 131898317

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of N-(3-methylcyclohexyl)pyridine-3-sulfonamide (CID 47331340) is N-(3-methylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(3-methylcyclohexyl)pyridine-3-sulfonamide is CC1CCCC(NS(=O)(=O)c2cccnc2)C1.
What is the InChIKey of N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is GXXUOUKUQITCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S/c1-10-4-2-5-11(8-10)14-17(15,16)12-6-3-7-13-9-12/h3,6-7,9-11,14H,2,4-5,8H2,1H3.
What are the key properties of N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
N-(3-methylcyclohexyl)pyridine-3-sulfonamide has a molecular weight of 254.35 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 47331340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).