N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C27H34N8O3 — CID 77465734

About N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 77465734) has the molecular formula C27H34N8O3 and a molecular weight of 518.62 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 77465734
• Molecular Formula: C27H34N8O3
• Molecular Weight: 518.62 g/mol
• Exact Mass: 518.28
• IUPAC Name: N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: CC1=CC(C)=NC(=O)C1CNC(=O)c1cc(-c2cnn(CCN3CCOCC3)c2)nc2c1cnn2C(C)C
• InChI: InChI=1S/C27H34N8O3/c1-17(2)35-25-23(15-30-35)21(26(36)28-14-22-18(3)11-19(4)31-27(22)37)12-24(32-25)20-13-29-34(16-20)6-5-33-7-9-38-10-8-33/h11-13,15-17,22H,5-10,14H2,1-4H3,(H,28,36)
• InChIKey: ICCDSJOKRBHCJG-UHFFFAOYSA-N
• XLogP: 2.50
• TPSA: 119.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 8
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	518.62
LogP ≤ 5	2.50
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 77465734) is N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CC1=CC(C)=NC(=O)C1CNC(=O)c1cc(-c2cnn(CCN3CCOCC3)c2)nc2c1cnn2C(C)C.

What is the InChIKey of N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is ICCDSJOKRBHCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N8O3/c1-17(2)35-25-23(15-30-35)21(26(36)28-14-22-18(3)11-19(4)31-27(22)37)12-24(32-25)20-13-29-34(16-20)6-5-33-7-9-38-10-8-33/h11-13,15-17,22H,5-10,14H2,1-4H3,(H,28,36).

What are the key properties of N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 518.62 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 77465734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).