disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate

C28H22Ag2N12O6 — CID 139138722

IUPACdisilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate
SMILESNc1nc(-c2ccccn2)cc(-c2ccccn2)n1.Nc1nc(-c2ccccn2)cc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ag+].[Ag+]
InChIInChI=1S/2C14H11N5.2Ag.2NO3/c2*15-14-18-12(10-5-1-3-7-16-10)9-13(19-14)11-6-2-4-8-17-11;;;2*2-1(3)4/h2*1-9H,(H2,15,18,19);;;;/q;;2*+1;2*-1
InChIKeyXCPWUUPIIPPMGX-UHFFFAOYSA-N
MW838.30 g/mol
LogP3.88
Rot. Bonds4

About disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate

disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate (PubChem CID 139138722) has the molecular formula C28H22Ag2N12O6 and a molecular weight of 838.30 g/mol. Its IUPAC name is disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate.

Molecular Properties

Compound Namedisilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate
PubChem CID139138722
Molecular FormulaC28H22Ag2N12O6
Molecular Weight838.30 g/mol
Exact Mass835.99
IUPAC Namedisilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate
SMILESNc1nc(-c2ccccn2)cc(-c2ccccn2)n1.Nc1nc(-c2ccccn2)cc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ag+].[Ag+]
InChIInChI=1S/2C14H11N5.2Ag.2NO3/c2*15-14-18-12(10-5-1-3-7-16-10)9-13(19-14)11-6-2-4-8-17-11;;;2*2-1(3)4/h2*1-9H,(H2,15,18,19);;;;/q;;2*+1;2*-1
InChIKeyXCPWUUPIIPPMGX-UHFFFAOYSA-N
XLogP3.88
TPSA287.56 Ų
H-Bond Donors2
H-Bond Acceptors16
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500838.30
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

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Related Compounds

2,4-Dipyridin-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 5061793
Imidazol-3-ide;bis(2-pyridin-2-ylpyridine);ruthenium(1+)
CID 444551
Imidazol-3-ide;osmium(1+);bis(2-pyridin-2-ylpyridine)
CID 446594
bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(1H-imidazol-1-yl)osmium(2+)
CID 137349190
bis(2,2'-bipyridine-kappa~2~N~1~,N~1'~)(1H-imidazol-1-yl)ruthenium(2+)
CID 137349193
4-Pyridin-2-yl-6-(6-pyridin-2-ylpyrimidin-4-yl)pyrimidine
CID 11483775
4-Pyridin-2-yl-6-(6-pyridin-2-yl-2-pyridinyl)pyrimidine
CID 12131466
Imidazol-3-ide;bis(2-pyridin-2-ylpyridine);ruthenium(3+)
CID 46936282
Imidazol-3-ide;osmium(2+);bis(2-pyridin-2-ylpyridine)
CID 46936698
3-Pyridin-2-yl-1-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)imidazo[1,5-a]pyridine
CID 60143892
Bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine;ruthenium(2+);dihexafluorophosphate
CID 139035237
Ammine(2,2'-bipyridine-kappa^2^N,N')silver(I) nitrate
CID 139060871

Frequently Asked Questions

What is the IUPAC name of disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate?
The IUPAC name of disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate (CID 139138722) is disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate.
What is the SMILES notation for disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate?
The canonical SMILES for disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate is Nc1nc(-c2ccccn2)cc(-c2ccccn2)n1.Nc1nc(-c2ccccn2)cc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ag+].[Ag+].
What is the InChIKey of disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate?
The InChIKey is XCPWUUPIIPPMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H11N5.2Ag.2NO3/c2*15-14-18-12(10-5-1-3-7-16-10)9-13(19-14)11-6-2-4-8-17-11;;;2*2-1(3)4/h2*1-9H,(H2,15,18,19);;;;/q;;2*+1;2*-1.
What are the key properties of disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate?
disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate has a molecular weight of 838.30 g/mol, XLogP of 3.88, 4 rotatable bonds, 2 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;bis(4,6-dipyridin-2-ylpyrimidin-2-amine);dinitrate is sourced from PubChem (CID 139138722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).