tris(2-pyridin-2-ylpyridine);ruthenium

C30H24N6Ru — CID 6100643

IUPACtris(2-pyridin-2-ylpyridine);ruthenium
SMILES[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/3C10H8N2.Ru/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;
InChIKeyBZSVVCFHMVMYCR-UHFFFAOYSA-N
MW569.63 g/mol
LogP6.43
Rot. Bonds3

About tris(2-pyridin-2-ylpyridine);ruthenium

tris(2-pyridin-2-ylpyridine);ruthenium (PubChem CID 6100643) has the molecular formula C30H24N6Ru and a molecular weight of 569.63 g/mol. Its IUPAC name is tris(2-pyridin-2-ylpyridine);ruthenium.

Molecular Properties

Compound Nametris(2-pyridin-2-ylpyridine);ruthenium
PubChem CID6100643
Molecular FormulaC30H24N6Ru
Molecular Weight569.63 g/mol
Exact Mass570.11
IUPAC Nametris(2-pyridin-2-ylpyridine);ruthenium
SMILES[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/3C10H8N2.Ru/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;
InChIKeyBZSVVCFHMVMYCR-UHFFFAOYSA-N
XLogP6.43
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms37
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500569.63
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of tris(2-pyridin-2-ylpyridine);ruthenium?
The IUPAC name of tris(2-pyridin-2-ylpyridine);ruthenium (CID 6100643) is tris(2-pyridin-2-ylpyridine);ruthenium.
What is the SMILES notation for tris(2-pyridin-2-ylpyridine);ruthenium?
The canonical SMILES for tris(2-pyridin-2-ylpyridine);ruthenium is [Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of tris(2-pyridin-2-ylpyridine);ruthenium?
The InChIKey is BZSVVCFHMVMYCR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H8N2.Ru/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;.
What are the key properties of tris(2-pyridin-2-ylpyridine);ruthenium?
tris(2-pyridin-2-ylpyridine);ruthenium has a molecular weight of 569.63 g/mol, XLogP of 6.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-pyridin-2-ylpyridine);ruthenium is sourced from PubChem (CID 6100643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).