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

C20H19N7O — CID 33018433

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

(6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone (PubChem CID 33018433) has the molecular formula C20H19N7O and a molecular weight of 373.42 g/mol. Its IUPAC name is (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
• PubChem CID: 33018433
• Molecular Formula: C20H19N7O
• Molecular Weight: 373.42 g/mol
• Exact Mass: 373.17
• IUPAC Name: (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
• SMILES: O=C(c1ccc(-n2ccnc2)nc1)N1CCC(c2nnc3ccccn23)CC1
• InChI: InChI=1S/C20H19N7O/c28-20(16-4-5-17(22-13-16)26-12-8-21-14-26)25-10-6-15(7-11-25)19-24-23-18-3-1-2-9-27(18)19/h1-5,8-9,12-15H,6-7,10-11H2
• InChIKey: VAEUTVFCVZEBCR-UHFFFAOYSA-N
• XLogP: 2.33
• TPSA: 81.21 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	373.42
LogP ≤ 5	2.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone (CID 33018433) is (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone.

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

The canonical SMILES for (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone is O=C(c1ccc(-n2ccnc2)nc1)N1CCC(c2nnc3ccccn23)CC1.

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

The InChIKey is VAEUTVFCVZEBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O/c28-20(16-4-5-17(22-13-16)26-12-8-21-14-26)25-10-6-15(7-11-25)19-24-23-18-3-1-2-9-27(18)19/h1-5,8-9,12-15H,6-7,10-11H2.

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

(6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone has a molecular weight of 373.42 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (6-imidazol-1-yl-3-pyridinyl)-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 33018433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).