6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

C24H26N6O — CID 112833096

About 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 112833096) has the molecular formula C24H26N6O and a molecular weight of 414.51 g/mol. Its IUPAC name is 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
• PubChem CID: 112833096
• Molecular Formula: C24H26N6O
• Molecular Weight: 414.51 g/mol
• Exact Mass: 414.22
• IUPAC Name: 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
• SMILES: Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1
• InChI: InChI=1S/C24H26N6O/c1-15(2)30-23-18(13-26-30)12-21(16(3)27-23)24(31)28-19-9-7-17(8-10-19)22-25-14-20-6-4-5-11-29(20)22/h7-10,12-15H,4-6,11H2,1-3H3,(H,28,31)
• InChIKey: ASDVBYLHZARIGF-UHFFFAOYSA-N
• XLogP: 4.77
• TPSA: 77.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	414.51
LogP ≤ 5	4.77
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The IUPAC name of 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (CID 112833096) is 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.

What is the SMILES notation for 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The canonical SMILES for 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1.

What is the InChIKey of 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

The InChIKey is ASDVBYLHZARIGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O/c1-15(2)30-23-18(13-26-30)12-21(16(3)27-23)24(31)28-19-9-7-17(8-10-19)22-25-14-20-6-4-5-11-29(20)22/h7-10,12-15H,4-6,11H2,1-3H3,(H,28,31).

What are the key properties of 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?

6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 414.51 g/mol, XLogP of 4.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-1-propan-2-yl-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 112833096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).