2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone

C17H12N6O2 — CID 157345823

IUPAC2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone
SMILESO=C(Cc1ccccn1)c1cc(Oc2cncnc2)cn2ncnc12
InChIInChI=1S/C17H12N6O2/c24-16(5-12-3-1-2-4-20-12)15-6-13(9-23-17(15)21-11-22-23)25-14-7-18-10-19-8-14/h1-4,6-11H,5H2
InChIKeyPUVKLGDLHCATCV-UHFFFAOYSA-N
MW332.32 g/mol
LogP2.13
Rot. Bonds5

About 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone

2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone (PubChem CID 157345823) has the molecular formula C17H12N6O2 and a molecular weight of 332.32 g/mol. Its IUPAC name is 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone.

Molecular Properties

Compound Name2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone
PubChem CID157345823
Molecular FormulaC17H12N6O2
Molecular Weight332.32 g/mol
Exact Mass332.10
IUPAC Name2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone
SMILESO=C(Cc1ccccn1)c1cc(Oc2cncnc2)cn2ncnc12
InChIInChI=1S/C17H12N6O2/c24-16(5-12-3-1-2-4-20-12)15-6-13(9-23-17(15)21-11-22-23)25-14-7-18-10-19-8-14/h1-4,6-11H,5H2
InChIKeyPUVKLGDLHCATCV-UHFFFAOYSA-N
XLogP2.13
TPSA95.16 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.32
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone?
The IUPAC name of 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone (CID 157345823) is 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone.
What is the SMILES notation for 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone?
The canonical SMILES for 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone is O=C(Cc1ccccn1)c1cc(Oc2cncnc2)cn2ncnc12.
What is the InChIKey of 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone?
The InChIKey is PUVKLGDLHCATCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N6O2/c24-16(5-12-3-1-2-4-20-12)15-6-13(9-23-17(15)21-11-22-23)25-14-7-18-10-19-8-14/h1-4,6-11H,5H2.
What are the key properties of 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone?
2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone has a molecular weight of 332.32 g/mol, XLogP of 2.13, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridin-8-yl)ethanone is sourced from PubChem (CID 157345823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).