2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium

C32H28N6Ru — CID 140706893

IUPAC2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium
SMILESCc1cccc(-c2cccc(C)n2)n1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H12N2.2C10H8N2.Ru/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3-8H,1-2H3;2*1-8H;
InChIKeyYJUYVQDIJZSKFK-UHFFFAOYSA-N
MW597.69 g/mol
LogP7.05
Rot. Bonds3

About 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium

2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium (PubChem CID 140706893) has the molecular formula C32H28N6Ru and a molecular weight of 597.69 g/mol. Its IUPAC name is 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium.

Molecular Properties

Compound Name2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium
PubChem CID140706893
Molecular FormulaC32H28N6Ru
Molecular Weight597.69 g/mol
Exact Mass598.14
IUPAC Name2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium
SMILESCc1cccc(-c2cccc(C)n2)n1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H12N2.2C10H8N2.Ru/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3-8H,1-2H3;2*1-8H;
InChIKeyYJUYVQDIJZSKFK-UHFFFAOYSA-N
XLogP7.05
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500597.69
LogP ≤ 57.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
2,3,5,6-Tetrakis(2-pyridyl)pyrazine
CID 3034360
Tris[2,2'-bipyridine]ruthenium dichloride
CID 84353
tris(2,2'-bipyridyl)cobalt(III)
CID 161059
Iron(2+), tris(2,2'-bipyridine-N,N')-, dichloride
CID 203609
Iron, tris(2,2'-bipyridine-kappaN1,kappaN1')-, (OC-6-11)-
CID 3032636
cis-Dichlorobis(2,2'-bipyridine)ruthenium(II) dihydrate
CID 2734543
cis-Bis(2,2'-bipyridyl)dichlororuthenium(II)
CID 6398695
Tris(2,2'-bipyridine)ruthenium(II) Bis(hexafluorophosphate)
CID 15198703
cis-Bis(2,2'-bipyridine)dichlororuthenium(II) hydrate
CID 16211844
Tris(2,2'-bipyridyl-d8)ruthenium(II) hexafluorophosphate
CID 71311090
2,2':6',2''-Terpyridine Platinum(Ii) Chloride
CID 444486

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium?
The IUPAC name of 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium (CID 140706893) is 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium.
What is the SMILES notation for 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium?
The canonical SMILES for 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium is Cc1cccc(-c2cccc(C)n2)n1.[Ru].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium?
The InChIKey is YJUYVQDIJZSKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2.2C10H8N2.Ru/c1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3-8H,1-2H3;2*1-8H;.
What are the key properties of 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium?
2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium has a molecular weight of 597.69 g/mol, XLogP of 7.05, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(6-methyl-2-pyridinyl)pyridine;bis(2-pyridin-2-ylpyridine);ruthenium is sourced from PubChem (CID 140706893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).