2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole

C14H15ClN6O3S — CID 162361079

About 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole

2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole (PubChem CID 162361079) has the molecular formula C14H15ClN6O3S and a molecular weight of 382.83 g/mol. Its IUPAC name is 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole.

Molecular Properties

• Compound Name: 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole
• PubChem CID: 162361079
• Molecular Formula: C14H15ClN6O3S
• Molecular Weight: 382.83 g/mol
• Exact Mass: 382.06
• IUPAC Name: 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole
• SMILES: Cc1nnc(S(=O)(=O)N2CCC(c3cn4ncnc4cc3Cl)CC2)o1
• InChI: InChI=1S/C14H15ClN6O3S/c1-9-18-19-14(24-9)25(22,23)20-4-2-10(3-5-20)11-7-21-13(6-12(11)15)16-8-17-21/h6-8,10H,2-5H2,1H3
• InChIKey: KCRKXJLXUJMVEL-UHFFFAOYSA-N
• XLogP: 1.64
• TPSA: 106.49 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 3
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	382.83
LogP ≤ 5	1.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole?

The IUPAC name of 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole (CID 162361079) is 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole.

What is the SMILES notation for 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole?

The canonical SMILES for 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole is Cc1nnc(S(=O)(=O)N2CCC(c3cn4ncnc4cc3Cl)CC2)o1.

What is the InChIKey of 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole?

The InChIKey is KCRKXJLXUJMVEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN6O3S/c1-9-18-19-14(24-9)25(22,23)20-4-2-10(3-5-20)11-7-21-13(6-12(11)15)16-8-17-21/h6-8,10H,2-5H2,1H3.

What are the key properties of 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole?

2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole has a molecular weight of 382.83 g/mol, XLogP of 1.64, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)piperidin-1-yl]sulfonyl-5-methyl-1,3,4-oxadiazole is sourced from PubChem (CID 162361079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).