1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone

C20H16FN5O2 — CID 147766328

About 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone

1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone (PubChem CID 147766328) has the molecular formula C20H16FN5O2 and a molecular weight of 377.38 g/mol. Its IUPAC name is 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone.

Molecular Properties

• Compound Name: 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone
• PubChem CID: 147766328
• Molecular Formula: C20H16FN5O2
• Molecular Weight: 377.38 g/mol
• Exact Mass: 377.13
• IUPAC Name: 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone
• SMILES: Cc1cccc(CC(=O)c2cc(Oc3cncc(F)c3)cn3nc(C)nc23)n1
• InChI: InChI=1S/C20H16FN5O2/c1-12-4-3-5-15(23-12)7-19(27)18-8-17(11-26-20(18)24-13(2)25-26)28-16-6-14(21)9-22-10-16/h3-6,8-11H,7H2,1-2H3
• InChIKey: HFBLASSPXNKFGJ-UHFFFAOYSA-N
• XLogP: 3.49
• TPSA: 82.27 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	377.38
LogP ≤ 5	3.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone?

The IUPAC name of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone (CID 147766328) is 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone.

What is the SMILES notation for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone?

The canonical SMILES for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone is Cc1cccc(CC(=O)c2cc(Oc3cncc(F)c3)cn3nc(C)nc23)n1.

What is the InChIKey of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone?

The InChIKey is HFBLASSPXNKFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5O2/c1-12-4-3-5-15(23-12)7-19(27)18-8-17(11-26-20(18)24-13(2)25-26)28-16-6-14(21)9-22-10-16/h3-6,8-11H,7H2,1-2H3.

What are the key properties of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone?

1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone has a molecular weight of 377.38 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(6-methyl-2-pyridinyl)ethanone is sourced from PubChem (CID 147766328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).