N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide

C₂₉H₃₅N₇O₂ — CID 149178905

About N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide

N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide (PubChem CID 149178905) has the molecular formula C₂₉H₃₅N₇O₂ and a molecular weight of 513.65 g/mol. Its IUPAC name is N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide
• PubChem CID: 149178905
• Molecular Formula: C₂₉H₃₅N₇O₂
• Molecular Weight: 513.65 g/mol
• Exact Mass: 513.29
• IUPAC Name: N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide
• SMILES: Cc1ncc(C(=O)NCCN2CCCCC2(C)C)cc1CC(=O)c1cnn2cc(-c3cnn(C)c3)ccc12
• InChI: InChI=1S/C29H35N7O2/c1-20-22(13-23(15-31-20)28(38)30-10-12-35-11-6-5-9-29(35,2)3)14-27(37)25-17-33-36-19-21(7-8-26(25)36)24-16-32-34(4)18-24/h7-8,13,15-19H,5-6,9-12,14H2,1-4H3,(H,30,38)
• InChIKey: XAODYOZABPRQQX-UHFFFAOYSA-N
• XLogP: 3.86
• TPSA: 97.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	513.65
LogP ≤ 5	3.86
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide?

The IUPAC name of N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide (CID 149178905) is N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide.

What is the SMILES notation for N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide?

The canonical SMILES for N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide is Cc1ncc(C(=O)NCCN2CCCCC2(C)C)cc1CC(=O)c1cnn2cc(-c3cnn(C)c3)ccc12.

What is the InChIKey of N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide?

The InChIKey is XAODYOZABPRQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H35N7O2/c1-20-22(13-23(15-31-20)28(38)30-10-12-35-11-6-5-9-29(35,2)3)14-27(37)25-17-33-36-19-21(7-8-26(25)36)24-16-32-34(4)18-24/h7-8,13,15-19H,5-6,9-12,14H2,1-4H3,(H,30,38).

What are the key properties of N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide?

N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide has a molecular weight of 513.65 g/mol, XLogP of 3.86, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(2,2-dimethylpiperidin-1-yl)ethyl]-6-methyl-5-[2-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]pyridine-3-carboxamide is sourced from PubChem (CID 149178905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 149178905 — identifiers, structure, computed properties (public domain)

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