(2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone

C21H21N7O — CID 131669003

About (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone

(2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone (PubChem CID 131669003) has the molecular formula C21H21N7O and a molecular weight of 387.45 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone
• PubChem CID: 131669003
• Molecular Formula: C21H21N7O
• Molecular Weight: 387.45 g/mol
• Exact Mass: 387.18
• IUPAC Name: (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone
• SMILES: Cn1nccc1C(=O)N1CCCC(c2nc3ccc(-c4cccnc4)cn3n2)C1
• InChI: InChI=1S/C21H21N7O/c1-26-18(8-10-23-26)21(29)27-11-3-5-17(13-27)20-24-19-7-6-16(14-28(19)25-20)15-4-2-9-22-12-15/h2,4,6-10,12,14,17H,3,5,11,13H2,1H3
• InChIKey: JGFUQVOTHJLYBX-UHFFFAOYSA-N
• XLogP: 2.54
• TPSA: 81.21 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	387.45
LogP ≤ 5	2.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?

The IUPAC name of (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone (CID 131669003) is (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone.

What is the SMILES notation for (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?

The canonical SMILES for (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone is Cn1nccc1C(=O)N1CCCC(c2nc3ccc(-c4cccnc4)cn3n2)C1.

What is the InChIKey of (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?

The InChIKey is JGFUQVOTHJLYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N7O/c1-26-18(8-10-23-26)21(29)27-11-3-5-17(13-27)20-24-19-7-6-16(14-28(19)25-20)15-4-2-9-22-12-15/h2,4,6-10,12,14,17H,3,5,11,13H2,1H3.

What are the key properties of (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone?

(2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone has a molecular weight of 387.45 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (2-methylpyrazol-3-yl)-[3-(6-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 131669003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).