dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate

C25H21N7ORu — CID 158088849

IUPACdipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate
SMILESO.[Ru].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(N=Nc2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H8N4.H2O.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)13-14-10-6-2-4-8-12-10;;/h1-11H;1-8H;1H2;
InChIKeyVCKGTAOXPPHPBX-UHFFFAOYSA-N
MW536.56 g/mol
LogP5.27
Rot. Bonds4

About dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate

dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate (PubChem CID 158088849) has the molecular formula C25H21N7ORu and a molecular weight of 536.56 g/mol. Its IUPAC name is dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate.

Molecular Properties

Compound Namedipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate
PubChem CID158088849
Molecular FormulaC25H21N7ORu
Molecular Weight536.56 g/mol
Exact Mass537.09
IUPAC Namedipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate
SMILESO.[Ru].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(N=Nc2ccccn2)nc1
InChIInChI=1S/C15H11N3.C10H8N4.H2O.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)13-14-10-6-2-4-8-12-10;;/h1-11H;1-8H;1H2;
InChIKeyVCKGTAOXPPHPBX-UHFFFAOYSA-N
XLogP5.27
TPSA120.67 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.56
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate with MolForge

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

Launch Full Analysis

Related Compounds

Tris(2,2a(2)-bipyridyl)dichlororuthenium(II) hexahydrate
CID 165340051
Tris(2,2'-bipyridine)nickel dichloride
CID 72193962
tris(2,2'-bipyridyl)dichlororuthenium(II) hexahydrate
CID 172897992
tris(2,2'-bipyridine)iron(II)
CID 6857601
tris(2,2'-bipyridine)ruthenium(II)
CID 44176403
[Pt(H2bapbpy)] platinum
CID 138753337
Tris(2,2'-bipyridyl)ruthenium(II) dichloride
CID 44140593
N-[[6-[(dipyridin-2-ylamino)methyl]-2-pyridinyl]methyl]-N-pyridin-2-ylpyridin-2-amine
CID 54279941
Tris(2,2'-bipyridine)diperchloratoruthenium
CID 139144531
Osmium(2+);tris(2-pyridin-2-ylpyridine)
CID 169409983
Tris(2,2a(2)-bipyridine)ruthenium(2+)
CID 3939621
Bis(2,2a(2)-bipyridine)dichlororuthenium monohydrate
CID 165360208

Frequently Asked Questions

What is the IUPAC name of dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate?
The IUPAC name of dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate (CID 158088849) is dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate.
What is the SMILES notation for dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate?
The canonical SMILES for dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate is O.[Ru].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(N=Nc2ccccn2)nc1.
What is the InChIKey of dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate?
The InChIKey is VCKGTAOXPPHPBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3.C10H8N4.H2O.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)13-14-10-6-2-4-8-12-10;;/h1-11H;1-8H;1H2;.
What are the key properties of dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate?
dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate has a molecular weight of 536.56 g/mol, XLogP of 5.27, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for dipyridin-2-yldiazene;2,6-dipyridin-2-ylpyridine;ruthenium;hydrate is sourced from PubChem (CID 158088849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).