6-cyano-N-cyclooctylpyridine-3-sulfonamide

C14H19N3O2S — CID 115602393

IUPAC6-cyano-N-cyclooctylpyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1
InChIInChI=1S/C14H19N3O2S/c15-10-13-8-9-14(11-16-13)20(18,19)17-12-6-4-2-1-3-5-7-12/h8-9,11-12,17H,1-7H2
InChIKeyIFHUIDOZMLJVGM-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.34
Rot. Bonds3

About 6-cyano-N-cyclooctylpyridine-3-sulfonamide

6-cyano-N-cyclooctylpyridine-3-sulfonamide (PubChem CID 115602393) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 6-cyano-N-cyclooctylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-cyclooctylpyridine-3-sulfonamide
PubChem CID115602393
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name6-cyano-N-cyclooctylpyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1
InChIInChI=1S/C14H19N3O2S/c15-10-13-8-9-14(11-16-13)20(18,19)17-12-6-4-2-1-3-5-7-12/h8-9,11-12,17H,1-7H2
InChIKeyIFHUIDOZMLJVGM-UHFFFAOYSA-N
XLogP2.34
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyano-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
CID 103653105
6-cyano-N-(2-hydroxycycloheptyl)pyridine-3-sulfonamide
CID 114613918
6-cyano-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 115602590
N-(2-chlorocyclohexyl)-6-cyanopyridine-3-sulfonamide
CID 106441981
6-cyano-N-(oxolan-3-yl)pyridine-3-sulfonamide
CID 113320215
6-cyano-N-(thiolan-3-yl)pyridine-3-sulfonamide
CID 103698000
cis-(1R,3S)-3-[(6-cyano-3-pyridinyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 106321509
6-cyano-N-(1,2-dimethylpiperidin-4-yl)pyridine-3-sulfonamide
CID 115650598
6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
CID 115602600
6-chloro-N-cyclooctylpyridine-3-sulfonamide
CID 7938157
6-cyano-N-(2,3-dimethylcyclopentyl)pyridine-3-sulfonamide
CID 114613875
6-cyano-N-[3-(cyclopropylamino)propyl]pyridine-3-sulfonamide
CID 114614830

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-cyclooctylpyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-cyclooctylpyridine-3-sulfonamide (CID 115602393) is 6-cyano-N-cyclooctylpyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-cyclooctylpyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-cyclooctylpyridine-3-sulfonamide is N#Cc1ccc(S(=O)(=O)NC2CCCCCCC2)cn1.
What is the InChIKey of 6-cyano-N-cyclooctylpyridine-3-sulfonamide?
The InChIKey is IFHUIDOZMLJVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c15-10-13-8-9-14(11-16-13)20(18,19)17-12-6-4-2-1-3-5-7-12/h8-9,11-12,17H,1-7H2.
What are the key properties of 6-cyano-N-cyclooctylpyridine-3-sulfonamide?
6-cyano-N-cyclooctylpyridine-3-sulfonamide has a molecular weight of 293.39 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-cyclooctylpyridine-3-sulfonamide is sourced from PubChem (CID 115602393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).