1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C28H23N7O2 — CID 55505283

About 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide

1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55505283) has the molecular formula C28H23N7O2 and a molecular weight of 489.54 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 55505283
• Molecular Formula: C28H23N7O2
• Molecular Weight: 489.54 g/mol
• Exact Mass: 489.19
• IUPAC Name: 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: Cn1ccnc1C(NC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1)c1ccccc1
• InChI: InChI=1S/C28H23N7O2/c1-34-13-12-30-27(34)25(19-7-3-2-4-8-19)33-28(36)22-15-24(20-9-5-11-29-16-20)32-26-23(22)17-31-35(26)18-21-10-6-14-37-21/h2-17,25H,18H2,1H3,(H,33,36)
• InChIKey: CZJWFGCWWLIZNL-UHFFFAOYSA-N
• XLogP: 4.39
• TPSA: 103.66 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	489.54
LogP ≤ 5	4.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 55505283) is 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is Cn1ccnc1C(NC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1)c1ccccc1.

What is the InChIKey of 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is CZJWFGCWWLIZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23N7O2/c1-34-13-12-30-27(34)25(19-7-3-2-4-8-19)33-28(36)22-15-24(20-9-5-11-29-16-20)32-26-23(22)17-31-35(26)18-21-10-6-14-37-21/h2-17,25H,18H2,1H3,(H,33,36).

What are the key properties of 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 489.54 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(furan-2-ylmethyl)-N-[(1-methylimidazol-2-yl)-phenylmethyl]-6-pyridin-3-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55505283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).