6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide

C12H15N3O3S — CID 114614808

IUPAC6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2(CO)CCCC2)cn1
InChIInChI=1S/C12H15N3O3S/c13-7-10-3-4-11(8-14-10)19(17,18)15-12(9-16)5-1-2-6-12/h3-4,8,15-16H,1-2,5-6,9H2
InChIKeyMOCIQTOCMACSNA-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.54
Rot. Bonds4

About 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide

6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide (PubChem CID 114614808) has the molecular formula C12H15N3O3S and a molecular weight of 281.34 g/mol. Its IUPAC name is 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
PubChem CID114614808
Molecular FormulaC12H15N3O3S
Molecular Weight281.34 g/mol
Exact Mass281.08
IUPAC Name6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2(CO)CCCC2)cn1
InChIInChI=1S/C12H15N3O3S/c13-7-10-3-4-11(8-14-10)19(17,18)15-12(9-16)5-1-2-6-12/h3-4,8,15-16H,1-2,5-6,9H2
InChIKeyMOCIQTOCMACSNA-UHFFFAOYSA-N
XLogP0.54
TPSA103.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]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-cyanocycloheptyl)pyridine-3-sulfonamide
CID 114613786
6-cyano-N-[(1-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 115754039
6-cyano-N-[(1-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 115618854
6-cyano-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]pyridine-3-sulfonamide
CID 107848455
4-cyano-N-[1-(hydroxymethyl)cyclopropyl]benzenesulfonamide
CID 115902827
4-fluoro-N-[1-(hydroxymethyl)cyclohexyl]benzenesulfonamide
CID 62519723
4-(bromomethyl)-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 65481622
4-ethyl-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 55082213
6-cyano-N-(cyclobutylmethyl)pyridine-3-sulfonamide
CID 115602600
4-N-[1-(hydroxymethyl)cyclobutyl]-1-N-methylbenzene-1,4-disulfonamide
CID 115903007
6-cyano-N-cyclooctylpyridine-3-sulfonamide
CID 115602393
4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide
CID 62522485

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide (CID 114614808) is 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide is N#Cc1ccc(S(=O)(=O)NC2(CO)CCCC2)cn1.
What is the InChIKey of 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The InChIKey is MOCIQTOCMACSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3S/c13-7-10-3-4-11(8-14-10)19(17,18)15-12(9-16)5-1-2-6-12/h3-4,8,15-16H,1-2,5-6,9H2.
What are the key properties of 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide is sourced from PubChem (CID 114614808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).