4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one

C20H17N7O — CID 46183523

About 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one

4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one (PubChem CID 46183523) has the molecular formula C20H17N7O and a molecular weight of 371.40 g/mol. Its IUPAC name is 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one.

Molecular Properties

• Compound Name: 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one
• PubChem CID: 46183523
• Molecular Formula: C20H17N7O
• Molecular Weight: 371.40 g/mol
• Exact Mass: 371.15
• IUPAC Name: 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one
• SMILES: Cc1[nH]nc2cc(Nc3nc4cccc(Cc5cc[nH]c(=O)c5)n4n3)ccc12
• InChI: InChI=1S/C20H17N7O/c1-12-16-6-5-14(11-17(16)25-24-12)22-20-23-18-4-2-3-15(27(18)26-20)9-13-7-8-21-19(28)10-13/h2-8,10-11H,9H2,1H3,(H,21,28)(H,22,26)(H,24,25)
• InChIKey: OPFRCUXMMPZCCZ-UHFFFAOYSA-N
• XLogP: 2.94
• TPSA: 103.76 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.40
LogP ≤ 5	2.94
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one?

The IUPAC name of 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one (CID 46183523) is 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one.

What is the SMILES notation for 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one?

The canonical SMILES for 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one is Cc1[nH]nc2cc(Nc3nc4cccc(Cc5cc[nH]c(=O)c5)n4n3)ccc12.

What is the InChIKey of 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one?

The InChIKey is OPFRCUXMMPZCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7O/c1-12-16-6-5-14(11-17(16)25-24-12)22-20-23-18-4-2-3-15(27(18)26-20)9-13-7-8-21-19(28)10-13/h2-8,10-11H,9H2,1H3,(H,21,28)(H,22,26)(H,24,25).

What are the key properties of 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one?

4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one has a molecular weight of 371.40 g/mol, XLogP of 2.94, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[2-[(3-methyl-2H-indazol-6-yl)amino]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methyl]-1H-pyridin-2-one is sourced from PubChem (CID 46183523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).