6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

C18H27N5O — CID 119555058

About 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide

6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide (PubChem CID 119555058) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
• PubChem CID: 119555058
• Molecular Formula: C18H27N5O
• Molecular Weight: 329.45 g/mol
• Exact Mass: 329.22
• IUPAC Name: 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
• SMILES: Cc1cc(C(=O)NCCC2CCCNC2)c2cnn(C(C)C)c2n1
• InChI: InChI=1S/C18H27N5O/c1-12(2)23-17-16(11-21-23)15(9-13(3)22-17)18(24)20-8-6-14-5-4-7-19-10-14/h9,11-12,14,19H,4-8,10H2,1-3H3,(H,20,24)
• InChIKey: CRKLAABTSGIPQJ-UHFFFAOYSA-N
• XLogP: 2.44
• TPSA: 71.84 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	329.45
LogP ≤ 5	2.44
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide (CID 119555058) is 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide.

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

The canonical SMILES for 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide is Cc1cc(C(=O)NCCC2CCCNC2)c2cnn(C(C)C)c2n1.

What is the InChIKey of 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide?

The InChIKey is CRKLAABTSGIPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-12(2)23-17-16(11-21-23)15(9-13(3)22-17)18(24)20-8-6-14-5-4-7-19-10-14/h9,11-12,14,19H,4-8,10H2,1-3H3,(H,20,24).

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

6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide has a molecular weight of 329.45 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 119555058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).