6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

C24H20N4O3 — CID 134037006

About 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide

6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 134037006) has the molecular formula C24H20N4O3 and a molecular weight of 412.45 g/mol. Its IUPAC name is 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 134037006
• Molecular Formula: C24H20N4O3
• Molecular Weight: 412.45 g/mol
• Exact Mass: 412.15
• IUPAC Name: 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)NC(c3ccccc3)c3ccco3)c12
• InChI: InChI=1S/C24H20N4O3/c1-15-21-17(14-18(19-10-6-12-30-19)25-23(21)28(2)27-15)24(29)26-22(20-11-7-13-31-20)16-8-4-3-5-9-16/h3-14,22H,1-2H3,(H,26,29)
• InChIKey: INLDKGICEXVSIC-UHFFFAOYSA-N
• XLogP: 4.65
• TPSA: 86.09 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	412.45
LogP ≤ 5	4.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 134037006) is 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)NC(c3ccccc3)c3ccco3)c12.

What is the InChIKey of 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is INLDKGICEXVSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O3/c1-15-21-17(14-18(19-10-6-12-30-19)25-23(21)28(2)27-15)24(29)26-22(20-11-7-13-31-20)16-8-4-3-5-9-16/h3-14,22H,1-2H3,(H,26,29).

What are the key properties of 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide?

6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 412.45 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]-1,3-dimethylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 134037006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).