N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C24H33N5O2S — CID 55521111

About N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55521111) has the molecular formula C24H33N5O2S and a molecular weight of 455.63 g/mol. Its IUPAC name is N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 55521111
• Molecular Formula: C24H33N5O2S
• Molecular Weight: 455.63 g/mol
• Exact Mass: 455.24
• IUPAC Name: N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: CC(C)CC(CNC(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C)N1CCOCC1
• InChI: InChI=1S/C24H33N5O2S/c1-16(2)12-18(28-7-9-31-10-8-28)14-25-24(30)19-13-21(22-6-5-11-32-22)27-23-20(19)15-26-29(23)17(3)4/h5-6,11,13,15-18H,7-10,12,14H2,1-4H3,(H,25,30)
• InChIKey: AJTFXYBXLQHTPO-UHFFFAOYSA-N
• XLogP: 4.22
• TPSA: 72.28 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 8
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	455.63
LogP ≤ 5	4.22
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 55521111) is N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CC(C)CC(CNC(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C)N1CCOCC1.

What is the InChIKey of N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is AJTFXYBXLQHTPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N5O2S/c1-16(2)12-18(28-7-9-31-10-8-28)14-25-24(30)19-13-21(22-6-5-11-32-22)27-23-20(19)15-26-29(23)17(3)4/h5-6,11,13,15-18H,7-10,12,14H2,1-4H3,(H,25,30).

What are the key properties of N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?

N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 455.63 g/mol, XLogP of 4.22, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-methyl-2-morpholin-4-ylpentyl)-1-propan-2-yl-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55521111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).