acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate

C21H20Cl2N6O8Pt — CID 139055029

IUPACacetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate
SMILESCC#N.Cn1ccnc1.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pt+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1
InChIInChI=1S/C15H11N3.C4H6N2.C2H3N.2ClHO4.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-6-3-2-5-4-6;1-2-3;2*2-1(3,4)5;/h1-11H;2-4H,1H3;1H3;2*(H,2,3,4,5);/q;;;;;+2/p-2
InChIKeyLHJQZNHZVWHMAV-UHFFFAOYSA-L
MW750.41 g/mol
LogP-5.36
Rot. Bonds2

About acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate

acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate (PubChem CID 139055029) has the molecular formula C21H20Cl2N6O8Pt and a molecular weight of 750.41 g/mol. Its IUPAC name is acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate.

Molecular Properties

Compound Nameacetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate
PubChem CID139055029
Molecular FormulaC21H20Cl2N6O8Pt
Molecular Weight750.41 g/mol
Exact Mass749.04
IUPAC Nameacetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate
SMILESCC#N.Cn1ccnc1.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pt+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1
InChIInChI=1S/C15H11N3.C4H6N2.C2H3N.2ClHO4.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-6-3-2-5-4-6;1-2-3;2*2-1(3,4)5;/h1-11H;2-4H,1H3;1H3;2*(H,2,3,4,5);/q;;;;;+2/p-2
InChIKeyLHJQZNHZVWHMAV-UHFFFAOYSA-L
XLogP-5.36
TPSA264.76 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500750.41
LogP ≤ 5-5.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

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Related Compounds

1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-tetramethylenebis(2-phenyl-, diperchlorate
CID 15588598
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-ethylenebis(2-phenyl-, diperchlorate
CID 15588600
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-hexamethylenebis(3-methyl-2-phenyl-, diperchlorate
CID 13318866
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-ethylenebis(3-methyl-2-phenyl-, diperchlorate
CID 15588581
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-hexamethylenebis(3-ethyl-2-phenyl-, diperchlorate
CID 15588583
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-octamethylenebis(3-methyl-2-phenyl-, diperchlorate
CID 15588589
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-tetramethylenebis(3-methyl-2-phenyl-, diperchlorate
CID 15588591
1H-Imidazo(1,2-a)pyridin-4-ium, 1,1'-vinylenebis(2-phenyl-, diperchlorate
CID 56843620
6,14,23,25-Tetraza-3,17-diazoniapentacyclo[17.3.1.13,6.18,12.114,17]hexacosa-1(23),3(26),4,8(25),9,11,15,17(24),19,21-decaene
CID 10993391
2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;iridium;2-[5-(trifluoromethyl)imidazol-3-id-4-yl]pyridine
CID 20807215
9,18-Dipyrrolidin-1-yl-10,17-diaza-8,19-diazoniahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(24),2,4,6,8,11,13,15,18,20,22-undecaene perchlorate
CID 393980
Bis(1-methylimidazole);platinum;2-pyridin-2-ylpyridine
CID 499510

Frequently Asked Questions

What is the IUPAC name of acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate?
The IUPAC name of acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate (CID 139055029) is acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate.
What is the SMILES notation for acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate?
The canonical SMILES for acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate is CC#N.Cn1ccnc1.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[Pt+2].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.
What is the InChIKey of acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate?
The InChIKey is LHJQZNHZVWHMAV-UHFFFAOYSA-L. The full InChI is InChI=1S/C15H11N3.C4H6N2.C2H3N.2ClHO4.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;1-6-3-2-5-4-6;1-2-3;2*2-1(3,4)5;/h1-11H;2-4H,1H3;1H3;2*(H,2,3,4,5);/q;;;;;+2/p-2.
What are the key properties of acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate?
acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate has a molecular weight of 750.41 g/mol, XLogP of -5.36, 2 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for acetonitrile;2,6-dipyridin-2-ylpyridine;1-methylimidazole;platinum(2+);diperchlorate is sourced from PubChem (CID 139055029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).