bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)

C150H125Ir5N15O5-10 — CID 158727072

About bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)

bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole) (PubChem CID 158727072) has the molecular formula C150H125Ir5N15O5-10 and a molecular weight of 3178.83 g/mol. Its IUPAC name is bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole).

Molecular Properties

• Compound Name: bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)
• PubChem CID: 158727072
• Molecular Formula: C150H125Ir5N15O5-10
• Molecular Weight: 3178.83 g/mol
• Exact Mass: 3180.82
• IUPAC Name: bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)
• SMILES: CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.Cc1cccc2c1oc1c(-c3ccccn3)[c-]ccc12.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1ccccn1.[c-]1ccc2c(oc3ccccc32)c1-c1ccccn1
• InChI: InChI=1S/2C19H14NO.C18H12NO.2C17H10NO.5C12H13N2.5Ir/c2*1-12-10-17(20-11-13(12)2)16-8-5-7-15-14-6-3-4-9-18(14)21-19(15)16;1-12-6-4-7-13-14-8-5-9-15(18(14)20-17(12)13)16-10-2-3-11-19-16;2*1-2-10-16-12(6-1)13-7-5-8-14(17(13)19-16)15-9-3-4-11-18-15;5*1-10(2)14-9-8-13-12(14)11-6-4-3-5-7-11;;;;;/h2*3-7,9-11H,1-2H3;2-8,10-11H,1H3;2*1-7,9-11H;5*3-6,8-10H,1-2H3;;;;;/q10*-1
• InChIKey: YAKMPQTYAZZKDG-UHFFFAOYSA-N
• XLogP: 38.43
• TPSA: 219.25 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 15
• Heavy Atoms: 175
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3178.83
LogP ≤ 5	38.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)?

The IUPAC name of bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole) (CID 158727072) is bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole).

What is the SMILES notation for bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)?

The canonical SMILES for bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole) is CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.CC(C)n1ccnc1-c1[c-]cccc1.Cc1cccc2c1oc1c(-c3ccccn3)[c-]ccc12.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.Cc1cnc(-c2[c-]ccc3c2oc2ccccc23)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ccccc32)c1-c1ccccn1.[c-]1ccc2c(oc3ccccc32)c1-c1ccccn1.

What is the InChIKey of bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)?

The InChIKey is YAKMPQTYAZZKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H14NO.C18H12NO.2C17H10NO.5C12H13N2.5Ir/c2*1-12-10-17(20-11-13(12)2)16-8-5-7-15-14-6-3-4-9-18(14)21-19(15)16;1-12-6-4-7-13-14-8-5-9-15(18(14)20-17(12)13)16-10-2-3-11-19-16;2*1-2-10-16-12(6-1)13-7-5-8-14(17(13)19-16)15-9-3-4-11-18-15;5*1-10(2)14-9-8-13-12(14)11-6-4-3-5-7-11;;;;;/h2*3-7,9-11H,1-2H3;2-8,10-11H,1H3;2*1-7,9-11H;5*3-6,8-10H,1-2H3;;;;;/q10*-1;;;;;.

What are the key properties of bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole)?

bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole) has a molecular weight of 3178.83 g/mol, XLogP of 38.43, 15 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-(3H-dibenzofuran-3-id-4-yl)-4,5-dimethylpyridine);bis(2-(3H-dibenzofuran-3-id-4-yl)pyridine);pentakis(iridium);2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(2-phenyl-1-propan-2-ylimidazole) is sourced from PubChem (CID 158727072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).