N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide

C19H19N7O2 — CID 100906616

About N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide

N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide (PubChem CID 100906616) has the molecular formula C19H19N7O2 and a molecular weight of 377.41 g/mol. Its IUPAC name is N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide.

Molecular Properties

• Compound Name: N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide
• PubChem CID: 100906616
• Molecular Formula: C19H19N7O2
• Molecular Weight: 377.41 g/mol
• Exact Mass: 377.16
• IUPAC Name: N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide
• SMILES: CCc1c(NC(=O)CCn2nc3ccccn3c2=O)n[nH]c1-c1ccncc1
• InChI: InChI=1S/C19H19N7O2/c1-2-14-17(13-6-9-20-10-7-13)22-23-18(14)21-16(27)8-12-26-19(28)25-11-4-3-5-15(25)24-26/h3-7,9-11H,2,8,12H2,1H3,(H2,21,22,23,27)
• InChIKey: QYWJNLQWGCJWPT-UHFFFAOYSA-N
• XLogP: 1.87
• TPSA: 109.97 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	377.41
LogP ≤ 5	1.87
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide?

The IUPAC name of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide (CID 100906616) is N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide.

What is the SMILES notation for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide?

The canonical SMILES for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide is CCc1c(NC(=O)CCn2nc3ccccn3c2=O)n[nH]c1-c1ccncc1.

What is the InChIKey of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide?

The InChIKey is QYWJNLQWGCJWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7O2/c1-2-14-17(13-6-9-20-10-7-13)22-23-18(14)21-16(27)8-12-26-19(28)25-11-4-3-5-15(25)24-26/h3-7,9-11H,2,8,12H2,1H3,(H2,21,22,23,27).

What are the key properties of N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide?

N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide has a molecular weight of 377.41 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-ethyl-5-pyridin-4-yl-1H-pyrazol-3-yl)-3-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)propanamide is sourced from PubChem (CID 100906616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).