2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate

C15H23Cl3N3O6Ru — CID 175003948

IUPAC2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate
SMILESO.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ru+3].c1cncc(-c2cccnc2-c2cccnc2)c1
InChIInChI=1S/C15H11N3.3ClH.6H2O.Ru/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;;;;;;;;/h1-11H;3*1H;6*1H2;/q;;;;;;;;;;+3/p-3
InChIKeyGASOHLJDUGRNIK-UHFFFAOYSA-K
MW548.79 g/mol
LogP-10.73
Rot. Bonds2

About 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate

2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate (PubChem CID 175003948) has the molecular formula C15H23Cl3N3O6Ru and a molecular weight of 548.79 g/mol. Its IUPAC name is 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate.

Molecular Properties

Compound Name2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate
PubChem CID175003948
Molecular FormulaC15H23Cl3N3O6Ru
Molecular Weight548.79 g/mol
Exact Mass547.97
IUPAC Name2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate
SMILESO.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ru+3].c1cncc(-c2cccnc2-c2cccnc2)c1
InChIInChI=1S/C15H11N3.3ClH.6H2O.Ru/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;;;;;;;;/h1-11H;3*1H;6*1H2;/q;;;;;;;;;;+3/p-3
InChIKeyGASOHLJDUGRNIK-UHFFFAOYSA-K
XLogP-10.73
TPSA227.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500548.79
LogP ≤ 5-10.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride
CID 175008055
2,3-dipyridin-3-ylpyridine;methane
CID 174971096
2,3-dipyridin-3-ylpyridine;hydrobromide
CID 175062851
calcium;2,3-dipyridin-3-ylpyridine;hydride
CID 174847287
2,3-dipyridin-3-ylpyridine;platinum(2+);dibromide
CID 175132894
3-phenyl-2-pyridin-3-ylpyridine
CID 140510629
disilver;2,3-dipyridin-3-ylpyridine;dinitrate
CID 174813132
2-iodo-3-pyridin-3-ylpyridine
CID 134338193
2-benzyl-3-(3-pyridin-3-yl-2-pyridinyl)pyridine
CID 175335350
5-fluoro-2,3-dipyridin-3-ylpyridine
CID 46316529
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
diphenyl-(3-pyridin-3-yl-2-pyridinyl)phosphane
CID 87862086

Frequently Asked Questions

What is the IUPAC name of 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate?
The IUPAC name of 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate (CID 175003948) is 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate.
What is the SMILES notation for 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate?
The canonical SMILES for 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate is O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Ru+3].c1cncc(-c2cccnc2-c2cccnc2)c1.
What is the InChIKey of 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate?
The InChIKey is GASOHLJDUGRNIK-UHFFFAOYSA-K. The full InChI is InChI=1S/C15H11N3.3ClH.6H2O.Ru/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;;;;;;;;/h1-11H;3*1H;6*1H2;/q;;;;;;;;;;+3/p-3.
What are the key properties of 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate?
2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate has a molecular weight of 548.79 g/mol, XLogP of -10.73, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate is sourced from PubChem (CID 175003948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).