1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide

C13H22N4O2S — CID 75494849

IUPAC1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide
SMILESO=S(=O)(CC1CCCCC1)NC1CCCn2ncnc21
InChIInChI=1S/C13H22N4O2S/c18-20(19,9-11-5-2-1-3-6-11)16-12-7-4-8-17-13(12)14-10-15-17/h10-12,16H,1-9H2
InChIKeyAPCJHLULJIYZCW-UHFFFAOYSA-N
MW298.41 g/mol
LogP1.61
Rot. Bonds4

About 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide

1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide (PubChem CID 75494849) has the molecular formula C13H22N4O2S and a molecular weight of 298.41 g/mol. Its IUPAC name is 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide
PubChem CID75494849
Molecular FormulaC13H22N4O2S
Molecular Weight298.41 g/mol
Exact Mass298.15
IUPAC Name1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide
SMILESO=S(=O)(CC1CCCCC1)NC1CCCn2ncnc21
InChIInChI=1S/C13H22N4O2S/c18-20(19,9-11-5-2-1-3-6-11)16-12-7-4-8-17-13(12)14-10-15-17/h10-12,16H,1-9H2
InChIKeyAPCJHLULJIYZCW-UHFFFAOYSA-N
XLogP1.61
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide (CID 75494849) is 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide is O=S(=O)(CC1CCCCC1)NC1CCCn2ncnc21.
What is the InChIKey of 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide?
The InChIKey is APCJHLULJIYZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S/c18-20(19,9-11-5-2-1-3-6-11)16-12-7-4-8-17-13(12)14-10-15-17/h10-12,16H,1-9H2.
What are the key properties of 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide?
1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide has a molecular weight of 298.41 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl)methanesulfonamide is sourced from PubChem (CID 75494849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).