2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide

C26H34N8O2 — CID 155226197

About 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide

2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide (PubChem CID 155226197) has the molecular formula C26H34N8O2 and a molecular weight of 490.61 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide.

Molecular Properties

• Compound Name: 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide
• PubChem CID: 155226197
• Molecular Formula: C26H34N8O2
• Molecular Weight: 490.61 g/mol
• Exact Mass: 490.28
• IUPAC Name: 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide
• SMILES: COc1cc(-c2[nH]c3cnc(N4CCC(NC(=O)CN(C)C)CC4)cc3c2C(C)C)cn2ncnc12
• InChI: InChI=1S/C26H34N8O2/c1-16(2)24-19-11-22(33-8-6-18(7-9-33)30-23(35)14-32(3)4)27-12-20(19)31-25(24)17-10-21(36-5)26-28-15-29-34(26)13-17/h10-13,15-16,18,31H,6-9,14H2,1-5H3,(H,30,35)
• InChIKey: PUCHNGROFKTZKH-UHFFFAOYSA-N
• XLogP: 3.05
• TPSA: 103.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	490.61
LogP ≤ 5	3.05
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide (CID 155226197) is 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide.

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

The canonical SMILES for 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide is COc1cc(-c2[nH]c3cnc(N4CCC(NC(=O)CN(C)C)CC4)cc3c2C(C)C)cn2ncnc12.

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

The InChIKey is PUCHNGROFKTZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N8O2/c1-16(2)24-19-11-22(33-8-6-18(7-9-33)30-23(35)14-32(3)4)27-12-20(19)31-25(24)17-10-21(36-5)26-28-15-29-34(26)13-17/h10-13,15-16,18,31H,6-9,14H2,1-5H3,(H,30,35).

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

2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide has a molecular weight of 490.61 g/mol, XLogP of 3.05, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(dimethylamino)-N-[1-[2-(8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-pyrrolo[2,3-c]pyridin-5-yl]piperidin-4-yl]acetamide is sourced from PubChem (CID 155226197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).