6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine

C30H36N10O — CID 164514245

About 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine

6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine (PubChem CID 164514245) has the molecular formula C30H36N10O and a molecular weight of 552.69 g/mol. Its IUPAC name is 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine
• PubChem CID: 164514245
• Molecular Formula: C30H36N10O
• Molecular Weight: 552.69 g/mol
• Exact Mass: 552.31
• IUPAC Name: 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine
• SMILES: COc1ccncc1-c1cc2c(cnn2-c2cc3c(nc(N4CCN(C)CC4)n3C)c(N3CCCCC3)n2)c(C)n1
• InChI: InChI=1S/C30H36N10O/c1-20-21-19-32-40(24(21)16-23(33-20)22-18-31-9-8-26(22)41-4)27-17-25-28(29(34-27)38-10-6-5-7-11-38)35-30(37(25)3)39-14-12-36(2)13-15-39/h8-9,16-19H,5-7,10-15H2,1-4H3
• InChIKey: VKJQJQFXCVUOJP-UHFFFAOYSA-N
• XLogP: 3.82
• TPSA: 93.26 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 5
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	552.69
LogP ≤ 5	3.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine?

The IUPAC name of 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine (CID 164514245) is 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine.

What is the SMILES notation for 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine?

The canonical SMILES for 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine is COc1ccncc1-c1cc2c(cnn2-c2cc3c(nc(N4CCN(C)CC4)n3C)c(N3CCCCC3)n2)c(C)n1.

What is the InChIKey of 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine?

The InChIKey is VKJQJQFXCVUOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H36N10O/c1-20-21-19-32-40(24(21)16-23(33-20)22-18-31-9-8-26(22)41-4)27-17-25-28(29(34-27)38-10-6-5-7-11-38)35-30(37(25)3)39-14-12-36(2)13-15-39/h8-9,16-19H,5-7,10-15H2,1-4H3.

What are the key properties of 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine?

6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine has a molecular weight of 552.69 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methyl-2-(4-methylpiperazin-1-yl)-4-piperidin-1-ylimidazo[4,5-c]pyridine is sourced from PubChem (CID 164514245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).