8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium

C58H56FIrN5OSi-2 — CID 156669426

About 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium

8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium (PubChem CID 156669426) has the molecular formula C58H56FIrN5OSi-2 and a molecular weight of 1078.42 g/mol. Its IUPAC name is 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium.

Molecular Properties

• Compound Name: 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium
• PubChem CID: 156669426
• Molecular Formula: C58H56FIrN5OSi-2
• Molecular Weight: 1078.42 g/mol
• Exact Mass: 1078.39
• IUPAC Name: 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium
• SMILES: CC(C)Cc1cc(-c2[c-]cc(F)cc2)ncc1[Si](C)(C)C.Cc1ccc2ccc3nc(-c4[c-]ccc5c4oc4nc(CC(C)C)ccc45)n(-c4c(C)cc(-c5ccccc5)cc4C)c3c2n1.[Ir]
• InChI: InChI=1S/C40H33N4O.C18H23FNSi.Ir/c1-23(2)20-30-17-18-32-31-12-9-13-33(38(31)45-40(32)42-30)39-43-34-19-16-28-15-14-26(5)41-35(28)37(34)44(39)36-24(3)21-29(22-25(36)4)27-10-7-6-8-11-27;1-13(2)10-15-11-17(14-6-8-16(19)9-7-14)20-12-18(15)21(3,4)5;/h6-12,14-19,21-23H,20H2,1-5H3;6,8-9,11-13H,10H2,1-5H3;/q2*-1
• InChIKey: VGPWSBQVPUSHNW-UHFFFAOYSA-N
• XLogP: 14.56
• TPSA: 69.63 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1078.42
LogP ≤ 5	14.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium?

The IUPAC name of 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium (CID 156669426) is 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium.

What is the SMILES notation for 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium?

The canonical SMILES for 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium is CC(C)Cc1cc(-c2[c-]cc(F)cc2)ncc1[Si](C)(C)C.Cc1ccc2ccc3nc(-c4[c-]ccc5c4oc4nc(CC(C)C)ccc45)n(-c4c(C)cc(-c5ccccc5)cc4C)c3c2n1.[Ir].

What is the InChIKey of 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium?

The InChIKey is VGPWSBQVPUSHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H33N4O.C18H23FNSi.Ir/c1-23(2)20-30-17-18-32-31-12-9-13-33(38(31)45-40(32)42-30)39-43-34-19-16-28-15-14-26(5)41-35(28)37(34)44(39)36-24(3)21-29(22-25(36)4)27-10-7-6-8-11-27;1-13(2)10-15-11-17(14-6-8-16(19)9-7-14)20-12-18(15)21(3,4)5;/h6-12,14-19,21-23H,20H2,1-5H3;6,8-9,11-13H,10H2,1-5H3;/q2*-1;.

What are the key properties of 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium?

8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium has a molecular weight of 1078.42 g/mol, XLogP of 14.56, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[1-(2,6-dimethyl-4-phenylphenyl)-8-methylimidazo[4,5-h]quinolin-2-yl]-2-(2-methylpropyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(4-fluorobenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;iridium is sourced from PubChem (CID 156669426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).