bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)

C22H22N4O2Pt — CID 59661433

IUPACbis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
SMILESCOc1ccc[c-]c1-c1cn(C)cn1.COc1ccc[c-]c1-c1cn(C)cn1.[Pt+2]
InChIInChI=1S/2C11H11N2O.Pt/c2*1-13-7-10(12-8-13)9-5-3-4-6-11(9)14-2;/h2*3-4,6-8H,1-2H3;/q2*-1;+2
InChIKeyZZICVJAIRLVFRF-UHFFFAOYSA-N
MW569.52 g/mol
LogP3.79
Rot. Bonds4

About bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)

bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) (PubChem CID 59661433) has the molecular formula C22H22N4O2Pt and a molecular weight of 569.52 g/mol. Its IUPAC name is bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+).

Molecular Properties

Compound Namebis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
PubChem CID59661433
Molecular FormulaC22H22N4O2Pt
Molecular Weight569.52 g/mol
Exact Mass569.14
IUPAC Namebis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
SMILESCOc1ccc[c-]c1-c1cn(C)cn1.COc1ccc[c-]c1-c1cn(C)cn1.[Pt+2]
InChIInChI=1S/2C11H11N2O.Pt/c2*1-13-7-10(12-8-13)9-5-3-4-6-11(9)14-2;/h2*3-4,6-8H,1-2H3;/q2*-1;+2
InChIKeyZZICVJAIRLVFRF-UHFFFAOYSA-N
XLogP3.79
TPSA54.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500569.52
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

4-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazole;[5-methoxy-2-(1-methylimidazol-4-yl)benzene-3-id-1-yl]methanol;platinum(2+)
CID 58401558
4-(2-Methoxybenzene-6-id-1-yl)-1-methylimidazole;[2-(1-methylimidazol-4-yl)benzene-3-id-1-yl]methanol;platinum(2+)
CID 58401613
4-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazole;4-(4-methoxy-2-methylbenzene-6-id-1-yl)-1-methylimidazole;platinum(2+)
CID 59661381
Iridium(3+);tris(4-(2-methoxybenzene-6-id-1-yl)-1,5-dimethylimidazole)
CID 59661536
1-methyl-3-[3-(1-methylimidazol-4-yl)-6H-cyclopenta[f][1]benzofuran-5-yl]-2H-imidazol-1-ium-2-ide
CID 161638904

Frequently Asked Questions

What is the IUPAC name of bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The IUPAC name of bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) (CID 59661433) is bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+).
What is the SMILES notation for bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The canonical SMILES for bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) is COc1ccc[c-]c1-c1cn(C)cn1.COc1ccc[c-]c1-c1cn(C)cn1.[Pt+2].
What is the InChIKey of bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The InChIKey is ZZICVJAIRLVFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H11N2O.Pt/c2*1-13-7-10(12-8-13)9-5-3-4-6-11(9)14-2;/h2*3-4,6-8H,1-2H3;/q2*-1;+2.
What are the key properties of bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) has a molecular weight of 569.52 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) is sourced from PubChem (CID 59661433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).