4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one

C26H26F2N8O2 — CID 163273372

About 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one

4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one (PubChem CID 163273372) has the molecular formula C26H26F2N8O2 and a molecular weight of 520.54 g/mol. Its IUPAC name is 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one.

Molecular Properties

• Compound Name: 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one
• PubChem CID: 163273372
• Molecular Formula: C26H26F2N8O2
• Molecular Weight: 520.54 g/mol
• Exact Mass: 520.21
• IUPAC Name: 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one
• SMILES: COc1ccncc1-c1cc2c(cnn2-c2cc3c(c(N4CCC(F)(F)CC4)n2)n(C)c(=O)n3C)c(C)n1
• InChI: InChI=1S/C26H26F2N8O2/c1-15-16-14-30-36(19(16)11-18(31-15)17-13-29-8-5-21(17)38-4)22-12-20-23(34(3)25(37)33(20)2)24(32-22)35-9-6-26(27,28)7-10-35/h5,8,11-14H,6-7,9-10H2,1-4H3
• InChIKey: MWIDKDCEIGFFCO-UHFFFAOYSA-N
• XLogP: 3.62
• TPSA: 95.89 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 4
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	520.54
LogP ≤ 5	3.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one?

The IUPAC name of 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one (CID 163273372) is 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one.

What is the SMILES notation for 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one?

The canonical SMILES for 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one is COc1ccncc1-c1cc2c(cnn2-c2cc3c(c(N4CCC(F)(F)CC4)n2)n(C)c(=O)n3C)c(C)n1.

What is the InChIKey of 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one?

The InChIKey is MWIDKDCEIGFFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26F2N8O2/c1-15-16-14-30-36(19(16)11-18(31-15)17-13-29-8-5-21(17)38-4)22-12-20-23(34(3)25(37)33(20)2)24(32-22)35-9-6-26(27,28)7-10-35/h5,8,11-14H,6-7,9-10H2,1-4H3.

What are the key properties of 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one?

4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one has a molecular weight of 520.54 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4,4-difluoropiperidin-1-yl)-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1,3-dimethylimidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 163273372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).