6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide

C13H17N3O2S — CID 115618854

IUPAC6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide
SMILESCC1(CNS(=O)(=O)c2ccc(C#N)nc2)CCCC1
InChIInChI=1S/C13H17N3O2S/c1-13(6-2-3-7-13)10-16-19(17,18)12-5-4-11(8-14)15-9-12/h4-5,9,16H,2-3,6-7,10H2,1H3
InChIKeyIYRJZJSNLXPNEB-UHFFFAOYSA-N
MW279.37 g/mol
LogP1.81
Rot. Bonds4

About 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide

6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide (PubChem CID 115618854) has the molecular formula C13H17N3O2S and a molecular weight of 279.37 g/mol. Its IUPAC name is 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide
PubChem CID115618854
Molecular FormulaC13H17N3O2S
Molecular Weight279.37 g/mol
Exact Mass279.10
IUPAC Name6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide
SMILESCC1(CNS(=O)(=O)c2ccc(C#N)nc2)CCCC1
InChIInChI=1S/C13H17N3O2S/c1-13(6-2-3-7-13)10-16-19(17,18)12-5-4-11(8-14)15-9-12/h4-5,9,16H,2-3,6-7,10H2,1H3
InChIKeyIYRJZJSNLXPNEB-UHFFFAOYSA-N
XLogP1.81
TPSA82.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-cyano-N-[(1-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 115754039
6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
CID 114614808
6-cyano-N-(1-cyanocycloheptyl)pyridine-3-sulfonamide
CID 114613786
6-cyano-N-propylpyridine-3-sulfonamide
CID 115602408
6-cyano-N-[(3-hydroxyoxolan-3-yl)methyl]pyridine-3-sulfonamide
CID 103848198
6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
CID 115602600
6-cyano-N-pentylpyridine-3-sulfonamide
CID 115602354
N-[3-(aminomethyl)pentan-3-yl]-6-cyanopyridine-3-sulfonamide
CID 115752426
6-cyano-N-[(2-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107418699
N-[(1-methylcyclopentyl)methyl]benzenesulfonamide
CID 63822875
6-cyano-N-(4,6-dimethylpyrimidin-2-yl)pyridine-3-sulfonamide
CID 104599450
6-cyano-N-(3-methylsulfonylpropyl)pyridine-3-sulfonamide
CID 115602709

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide (CID 115618854) is 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide is CC1(CNS(=O)(=O)c2ccc(C#N)nc2)CCCC1.
What is the InChIKey of 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
The InChIKey is IYRJZJSNLXPNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2S/c1-13(6-2-3-7-13)10-16-19(17,18)12-5-4-11(8-14)15-9-12/h4-5,9,16H,2-3,6-7,10H2,1H3.
What are the key properties of 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide?
6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide has a molecular weight of 279.37 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 115618854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).