8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium

C63H66GeIrN6O-2 — CID 156671601

About 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium

8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium (PubChem CID 156671601) has the molecular formula C63H66GeIrN6O-2 and a molecular weight of 1188.09 g/mol. Its IUPAC name is 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium.

Molecular Properties

• Compound Name: 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium
• PubChem CID: 156671601
• Molecular Formula: C63H66GeIrN6O-2
• Molecular Weight: 1188.09 g/mol
• Exact Mass: 1189.42
• IUPAC Name: 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium
• SMILES: Cc1c[c-]c(-c2cc(CC(C)C)c([Ge](C)(C)C)cn2)c(C)n1.Cc1ccc2c(ccc3nc(-c4[c-]ccc5c4oc4nc(CC6CCCC6)ccc45)n(-c4ccc(-c5ccccc5)cc4C(C)(C)C)c32)n1.[Ir]
• InChI: InChI=1S/C44H39N4O.C19H27GeN2.Ir/c1-27-17-20-34-37(45-27)22-23-38-40(34)48(39-24-18-30(26-36(39)44(2,3)4)29-13-6-5-7-14-29)42(47-38)35-16-10-15-32-33-21-19-31(25-28-11-8-9-12-28)46-43(33)49-41(32)35;1-13(2)10-16-11-19(21-12-18(16)20(5,6)7)17-9-8-14(3)22-15(17)4;/h5-7,10,13-15,17-24,26,28H,8-9,11-12,25H2,1-4H3;8,11-13H,10H2,1-7H3;/q2*-1
• InChIKey: XXPBZNQVHVBQGN-UHFFFAOYSA-N
• XLogP: 15.64
• TPSA: 82.52 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 9
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1188.09
LogP ≤ 5	15.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium (CID 156671601) is 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium.

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

The canonical SMILES for 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium is Cc1c[c-]c(-c2cc(CC(C)C)c([Ge](C)(C)C)cn2)c(C)n1.Cc1ccc2c(ccc3nc(-c4[c-]ccc5c4oc4nc(CC6CCCC6)ccc45)n(-c4ccc(-c5ccccc5)cc4C(C)(C)C)c32)n1.[Ir].

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

The InChIKey is XXPBZNQVHVBQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H39N4O.C19H27GeN2.Ir/c1-27-17-20-34-37(45-27)22-23-38-40(34)48(39-24-18-30(26-36(39)44(2,3)4)29-13-6-5-7-14-29)42(47-38)35-16-10-15-32-33-21-19-31(25-28-11-8-9-12-28)46-43(33)49-41(32)35;1-13(2)10-16-11-19(21-12-18(16)20(5,6)7)17-9-8-14(3)22-15(17)4;/h5-7,10,13-15,17-24,26,28H,8-9,11-12,25H2,1-4H3;8,11-13H,10H2,1-7H3;/q2*-1;.

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

8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium has a molecular weight of 1188.09 g/mol, XLogP of 15.64, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[1-(2-tert-butyl-4-phenylphenyl)-7-methylimidazo[4,5-f]quinolin-2-yl]-2-(cyclopentylmethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2,6-dimethyl-4H-pyridin-4-id-3-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium is sourced from PubChem (CID 156671601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).