4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium

C61H54FGeIrN5O2-2 — CID 169322460

About 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium

4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium (PubChem CID 169322460) has the molecular formula C61H54FGeIrN5O2-2 and a molecular weight of 1172.96 g/mol. Its IUPAC name is 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium.

Molecular Properties

• Compound Name: 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium
• PubChem CID: 169322460
• Molecular Formula: C61H54FGeIrN5O2-2
• Molecular Weight: 1172.96 g/mol
• Exact Mass: 1174.31
• IUPAC Name: 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium
• SMILES: CC(C)(C)c1ccnc(-c2[c-]cc(F)cc2)c1.CC(C)c1cc2c(oc3cc(-c4ccc([Ge](C)(C)C)cc4)ccc32)c(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2nc(C#N)ccc23)nc2ccccc21.[Ir]
• InChI: InChI=1S/C46H39GeN4O2.C15H15FN.Ir/c1-26(2)36-24-37-32-21-17-29(28-15-18-30(19-16-28)47(5,6)7)23-40(32)52-44(37)41(27(3)4)42(36)51-39-14-9-8-13-38(39)50-45(51)35-12-10-11-33-34-22-20-31(25-48)49-46(34)53-43(33)35;1-15(2,3)12-8-9-17-14(10-12)11-4-6-13(16)7-5-11;/h8-11,13-24,26-27H,1-7H3;4,6-10H,1-3H3;/q2*-1
• InChIKey: UEZQNRFSBJTRQY-UHFFFAOYSA-N
• XLogP: 16.00
• TPSA: 93.67 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1172.96
LogP ≤ 5	16.00
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 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium?

The IUPAC name of 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium (CID 169322460) is 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium.

What is the SMILES notation for 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium?

The canonical SMILES for 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium is CC(C)(C)c1ccnc(-c2[c-]cc(F)cc2)c1.CC(C)c1cc2c(oc3cc(-c4ccc([Ge](C)(C)C)cc4)ccc32)c(C(C)C)c1-n1c(-c2[c-]ccc3c2oc2nc(C#N)ccc23)nc2ccccc21.[Ir].

What is the InChIKey of 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium?

The InChIKey is UEZQNRFSBJTRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H39GeN4O2.C15H15FN.Ir/c1-26(2)36-24-37-32-21-17-29(28-15-18-30(19-16-28)47(5,6)7)23-40(32)52-44(37)41(27(3)4)42(36)51-39-14-9-8-13-38(39)50-45(51)35-12-10-11-33-34-22-20-31(25-48)49-46(34)53-43(33)35;1-15(2,3)12-8-9-17-14(10-12)11-4-6-13(16)7-5-11;/h8-11,13-24,26-27H,1-7H3;4,6-10H,1-3H3;/q2*-1;.

What are the key properties of 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium?

4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium has a molecular weight of 1172.96 g/mol, XLogP of 16.00, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-(4-fluorobenzene-6-id-1-yl)pyridine;8-[1-[2,4-di(propan-2-yl)-7-(4-trimethylgermylphenyl)dibenzofuran-3-yl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide-2-carbonitrile;iridium is sourced from PubChem (CID 169322460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).