N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C₂₄H₂₃N₅O₂ — CID 9120241

About N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 9120241) has the molecular formula C₂₄H₂₃N₅O₂ and a molecular weight of 413.48 g/mol. Its IUPAC name is N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 9120241
• Molecular Formula: C₂₄H₂₃N₅O₂
• Molecular Weight: 413.48 g/mol
• Exact Mass: 413.19
• IUPAC Name: N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: CNC(=O)c1cccc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)c1
• InChI: InChI=1S/C24H23N5O2/c1-15(2)29-22-20(14-26-29)19(13-21(28-22)16-8-5-4-6-9-16)24(31)27-18-11-7-10-17(12-18)23(30)25-3/h4-15H,1-3H3,(H,25,30)(H,27,31)
• InChIKey: VITLGFXLWGGVCS-UHFFFAOYSA-N
• XLogP: 4.29
• TPSA: 88.91 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	413.48
LogP ≤ 5	4.29
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 9120241) is N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CNC(=O)c1cccc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)c1.

What is the InChIKey of N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is VITLGFXLWGGVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O2/c1-15(2)29-22-20(14-26-29)19(13-21(28-22)16-8-5-4-6-9-16)24(31)27-18-11-7-10-17(12-18)23(30)25-3/h4-15H,1-3H3,(H,25,30)(H,27,31).

What are the key properties of N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 4.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(methylcarbamoyl)phenyl]-6-phenyl-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9120241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 9120241 — identifiers, structure, computed properties (public domain)

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