bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone

C23H14N8O — CID 118706530

IUPACbis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone
SMILESO=C(c1cccc(-c2nnn3ccccc23)n1)c1cccc(-c2nnn3ccccc23)n1
InChIInChI=1S/C23H14N8O/c32-23(17-9-5-7-15(24-17)21-19-11-1-3-13-30(19)28-26-21)18-10-6-8-16(25-18)22-20-12-2-4-14-31(20)29-27-22/h1-14H
InChIKeyZMJFJHPGFJFALD-UHFFFAOYSA-N
MW418.42 g/mol
LogP3.13
Rot. Bonds4

About bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone

bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone (PubChem CID 118706530) has the molecular formula C23H14N8O and a molecular weight of 418.42 g/mol. Its IUPAC name is bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone.

Molecular Properties

Compound Namebis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone
PubChem CID118706530
Molecular FormulaC23H14N8O
Molecular Weight418.42 g/mol
Exact Mass418.13
IUPAC Namebis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone
SMILESO=C(c1cccc(-c2nnn3ccccc23)n1)c1cccc(-c2nnn3ccccc23)n1
InChIInChI=1S/C23H14N8O/c32-23(17-9-5-7-15(24-17)21-19-11-1-3-13-30(19)28-26-21)18-10-6-8-16(25-18)22-20-12-2-4-14-31(20)29-27-22/h1-14H
InChIKeyZMJFJHPGFJFALD-UHFFFAOYSA-N
XLogP3.13
TPSA103.23 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.42
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone?
The IUPAC name of bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone (CID 118706530) is bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone.
What is the SMILES notation for bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone?
The canonical SMILES for bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone is O=C(c1cccc(-c2nnn3ccccc23)n1)c1cccc(-c2nnn3ccccc23)n1.
What is the InChIKey of bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone?
The InChIKey is ZMJFJHPGFJFALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14N8O/c32-23(17-9-5-7-15(24-17)21-19-11-1-3-13-30(19)28-26-21)18-10-6-8-16(25-18)22-20-12-2-4-14-31(20)29-27-22/h1-14H.
What are the key properties of bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone?
bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone has a molecular weight of 418.42 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for bis[6-(triazolo[1,5-a]pyridin-3-yl)-2-pyridinyl]methanone is sourced from PubChem (CID 118706530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).