7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine

C23H28N6 — CID 155226265

About 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine

7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 155226265) has the molecular formula C23H28N6 and a molecular weight of 388.52 g/mol. Its IUPAC name is 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

• Compound Name: 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
• PubChem CID: 155226265
• Molecular Formula: C23H28N6
• Molecular Weight: 388.52 g/mol
• Exact Mass: 388.24
• IUPAC Name: 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
• SMILES: Cc1c(-c2[nH]c3cnc(C4CCNCC4)cc3c2C(C)C)cn2ncnc2c1C
• InChI: InChI=1S/C23H28N6/c1-13(2)21-17-9-19(16-5-7-24-8-6-16)25-10-20(17)28-22(21)18-11-29-23(26-12-27-29)15(4)14(18)3/h9-13,16,24,28H,5-8H2,1-4H3
• InChIKey: WFLWFYHGBMVVRW-UHFFFAOYSA-N
• XLogP: 4.48
• TPSA: 70.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	388.52
LogP ≤ 5	4.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?

The IUPAC name of 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 155226265) is 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.

What is the SMILES notation for 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?

The canonical SMILES for 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1c(-c2[nH]c3cnc(C4CCNCC4)cc3c2C(C)C)cn2ncnc2c1C.

What is the InChIKey of 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?

The InChIKey is WFLWFYHGBMVVRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N6/c1-13(2)21-17-9-19(16-5-7-24-8-6-16)25-10-20(17)28-22(21)18-11-29-23(26-12-27-29)15(4)14(18)3/h9-13,16,24,28H,5-8H2,1-4H3.

What are the key properties of 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?

7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 388.52 g/mol, XLogP of 4.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7,8-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 155226265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).