1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide

C24H19N5OS — CID 55817372

About 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide

1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55817372) has the molecular formula C24H19N5OS and a molecular weight of 425.52 g/mol. Its IUPAC name is 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
• PubChem CID: 55817372
• Molecular Formula: C24H19N5OS
• Molecular Weight: 425.52 g/mol
• Exact Mass: 425.13
• IUPAC Name: 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide
• SMILES: CCn1ncc2c(C(=O)Nc3cccc(-c4nccs4)c3)cc(-c3ccccc3)nc21
• InChI: InChI=1S/C24H19N5OS/c1-2-29-22-20(15-26-29)19(14-21(28-22)16-7-4-3-5-8-16)23(30)27-18-10-6-9-17(13-18)24-25-11-12-31-24/h3-15H,2H2,1H3,(H,27,30)
• InChIKey: RPCJCCKIYGLAGV-UHFFFAOYSA-N
• XLogP: 5.49
• TPSA: 72.70 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	425.52
LogP ≤ 5	5.49
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?

The IUPAC name of 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide (CID 55817372) is 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide.

What is the SMILES notation for 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?

The canonical SMILES for 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide is CCn1ncc2c(C(=O)Nc3cccc(-c4nccs4)c3)cc(-c3ccccc3)nc21.

What is the InChIKey of 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?

The InChIKey is RPCJCCKIYGLAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5OS/c1-2-29-22-20(15-26-29)19(14-21(28-22)16-7-4-3-5-8-16)23(30)27-18-10-6-9-17(13-18)24-25-11-12-31-24/h3-15H,2H2,1H3,(H,27,30).

What are the key properties of 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide?

1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 425.52 g/mol, XLogP of 5.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-ethyl-6-phenyl-N-[3-(1,3-thiazol-2-yl)phenyl]pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55817372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).