iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane

C58H56GeIrN4O-2 — CID 156671245

About iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane

iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane (PubChem CID 156671245) has the molecular formula C58H56GeIrN4O-2 and a molecular weight of 1089.94 g/mol. Its IUPAC name is iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane.

Molecular Properties

• Compound Name: iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane
• PubChem CID: 156671245
• Molecular Formula: C58H56GeIrN4O-2
• Molecular Weight: 1089.94 g/mol
• Exact Mass: 1091.33
• IUPAC Name: iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane
• SMILES: CC(C)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.Cc1ccc2c(n1)oc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccc5ccccc5c4)cc3C(C)C)[c-]ccc12.[Ir]
• InChI: InChI=1S/C41H34N3O.C17H22GeN.Ir/c1-24(2)34-22-30(29-19-18-27-11-6-7-12-28(27)21-29)23-35(25(3)4)38(34)44-37-16-9-8-15-36(37)43-40(44)33-14-10-13-31-32-20-17-26(5)42-41(32)45-39(31)33;1-13(2)15-11-17(14-9-7-6-8-10-14)19-12-16(15)18(3,4)5;/h6-13,15-25H,1-5H3;6-9,11-13H,1-5H3;/q2*-1
• InChIKey: ASCXRJRLEXRCNR-UHFFFAOYSA-N
• XLogP: 15.38
• TPSA: 56.74 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1089.94
LogP ≤ 5	15.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane?

The IUPAC name of iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane (CID 156671245) is iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane.

What is the SMILES notation for iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane?

The canonical SMILES for iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane is CC(C)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.Cc1ccc2c(n1)oc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccc5ccccc5c4)cc3C(C)C)[c-]ccc12.[Ir].

What is the InChIKey of iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane?

The InChIKey is ASCXRJRLEXRCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H34N3O.C17H22GeN.Ir/c1-24(2)34-22-30(29-19-18-27-11-6-7-12-28(27)21-29)23-35(25(3)4)38(34)44-37-16-9-8-15-36(37)43-40(44)33-14-10-13-31-32-20-17-26(5)42-41(32)45-39(31)33;1-13(2)15-11-17(14-9-7-6-8-10-14)19-12-16(15)18(3,4)5;/h6-13,15-25H,1-5H3;6-9,11-13H,1-5H3;/q2*-1;.

What are the key properties of iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane?

iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane has a molecular weight of 1089.94 g/mol, XLogP of 15.38, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for iridium;2-methyl-8-[1-[4-naphthalen-2-yl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)germane is sourced from PubChem (CID 156671245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).