1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

C24H21N7O — CID 167942015

About 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide

1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 167942015) has the molecular formula C24H21N7O and a molecular weight of 423.48 g/mol. Its IUPAC name is 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 167942015
• Molecular Formula: C24H21N7O
• Molecular Weight: 423.48 g/mol
• Exact Mass: 423.18
• IUPAC Name: 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: Cn1ncc2c(NC(=O)c3cc(C4CC4)nc4c3cnn4Cc3ccccc3)ccnc21
• InChI: InChI=1S/C24H21N7O/c1-30-22-19(13-26-30)20(9-10-25-22)29-24(32)17-11-21(16-7-8-16)28-23-18(17)12-27-31(23)14-15-5-3-2-4-6-15/h2-6,9-13,16H,7-8,14H2,1H3,(H,25,29,32)
• InChIKey: VEGPWGBWKNRPFL-UHFFFAOYSA-N
• XLogP: 3.89
• TPSA: 90.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	423.48
LogP ≤ 5	3.89
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 167942015) is 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is Cn1ncc2c(NC(=O)c3cc(C4CC4)nc4c3cnn4Cc3ccccc3)ccnc21.

What is the InChIKey of 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is VEGPWGBWKNRPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N7O/c1-30-22-19(13-26-30)20(9-10-25-22)29-24(32)17-11-21(16-7-8-16)28-23-18(17)12-27-31(23)14-15-5-3-2-4-6-15/h2-6,9-13,16H,7-8,14H2,1H3,(H,25,29,32).

What are the key properties of 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide?

1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 423.48 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-benzyl-6-cyclopropyl-N-(1-methylpyrazolo[3,4-b]pyridin-4-yl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 167942015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).