2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate

C25H20ClN7O6Ru — CID 139130055

IUPAC2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate
SMILESO=N[O-].[O-][Cl+3]([O-])([O-])[O-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H9N3.ClHO4.HNO2.Ru/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2-1(3,4)5;2-1-3;/h1-11H;1-8H,(H,11,12,13);(H,2,3,4,5);(H,2,3);/q;;;;+2/p-2
InChIKeyDQNLCTKKMRKLDL-UHFFFAOYSA-L
MW651.00 g/mol
LogP0.92
Rot. Bonds4

About 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate

2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate (PubChem CID 139130055) has the molecular formula C25H20ClN7O6Ru and a molecular weight of 651.00 g/mol. Its IUPAC name is 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate.

Molecular Properties

Compound Name2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate
PubChem CID139130055
Molecular FormulaC25H20ClN7O6Ru
Molecular Weight651.00 g/mol
Exact Mass651.02
IUPAC Name2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate
SMILESO=N[O-].[O-][Cl+3]([O-])([O-])[O-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H9N3.ClHO4.HNO2.Ru/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2-1(3,4)5;2-1-3;/h1-11H;1-8H,(H,11,12,13);(H,2,3,4,5);(H,2,3);/q;;;;+2/p-2
InChIKeyDQNLCTKKMRKLDL-UHFFFAOYSA-L
XLogP0.92
TPSA221.21 Ų
H-Bond Donors1
H-Bond Acceptors13
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500651.00
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,6-dipyridin-2-ylpyridin-2-amine
CID 69235188
dipyridin-2-ylmethanone;2,6-dipyridin-2-ylpyridine;ruthenium(2+);nitrite;perchlorate
CID 139129650
manganese(2+);2-pyridin-2-yl-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;diperchlorate;dihydrate
CID 11061040
N-(5-fluoro-2-pyridinyl)-6-pyridin-2-ylpyridin-2-amine
CID 69234797
palladium(2+);bis(2-pyridin-2-ylpyridine);diperchlorate
CID 19810782
azane;cobalt(3+);bis(2-pyridin-2-ylpyridine);triperchlorate
CID 139154451
N-pyridin-2-ylpyridin-2-amine;hydrochloride
CID 517616
copper;2,6-dipyridin-2-ylpyridine;diacetate;hydrate
CID 139207056
copper;oxalate;N-pyridin-2-ylpyridin-2-amine;dihydrate
CID 139059840
silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate
CID 139086290
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847

Frequently Asked Questions

What is the IUPAC name of 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate?
The IUPAC name of 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate (CID 139130055) is 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate.
What is the SMILES notation for 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate?
The canonical SMILES for 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate is O=N[O-].[O-][Cl+3]([O-])([O-])[O-].[Ru+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(Nc2ccccn2)nc1.
What is the InChIKey of 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate?
The InChIKey is DQNLCTKKMRKLDL-UHFFFAOYSA-L. The full InChI is InChI=1S/C15H11N3.C10H9N3.ClHO4.HNO2.Ru/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;2-1(3,4)5;2-1-3;/h1-11H;1-8H,(H,11,12,13);(H,2,3,4,5);(H,2,3);/q;;;;+2/p-2.
What are the key properties of 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate?
2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate has a molecular weight of 651.00 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipyridin-2-ylpyridine;N-pyridin-2-ylpyridin-2-amine;ruthenium(2+);nitrite;perchlorate is sourced from PubChem (CID 139130055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).