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

C59H56GeIrN4O-2 — CID 156667886

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

iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane (PubChem CID 156667886) has the molecular formula C59H56GeIrN4O-2 and a molecular weight of 1101.95 g/mol. Its IUPAC name is iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane.

Molecular Properties

• Compound Name: iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane
• PubChem CID: 156667886
• Molecular Formula: C59H56GeIrN4O-2
• Molecular Weight: 1101.95 g/mol
• Exact Mass: 1103.33
• IUPAC Name: iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane
• SMILES: CC(c1ccccc1)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.Cc1ccc2c(n1)oc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]ccc12.[Ir]
• InChI: InChI=1S/C37H32N3O.C22H24GeN.Ir/c1-22(2)30-20-26(25-12-7-6-8-13-25)21-31(23(3)4)34(30)40-33-17-10-9-16-32(33)39-36(40)29-15-11-14-27-28-19-18-24(5)38-37(28)41-35(27)29;1-17(18-11-7-5-8-12-18)20-15-22(19-13-9-6-10-14-19)24-16-21(20)23(2,3)4;/h6-14,16-23H,1-5H3;5-13,15-17H,1-4H3;/q2*-1
• InChIKey: IDXRPFIYCVWXKZ-UHFFFAOYSA-N
• XLogP: 15.25
• TPSA: 56.74 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1101.95
LogP ≤ 5	15.25
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-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane?

The IUPAC name of iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane (CID 156667886) is iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane.

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

The canonical SMILES for iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane is CC(c1ccccc1)c1cc(-c2[c-]cccc2)ncc1[Ge](C)(C)C.Cc1ccc2c(n1)oc1c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccccc4)cc3C(C)C)[c-]ccc12.[Ir].

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

The InChIKey is IDXRPFIYCVWXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H32N3O.C22H24GeN.Ir/c1-22(2)30-20-26(25-12-7-6-8-13-25)21-31(23(3)4)34(30)40-33-17-10-9-16-32(33)39-36(40)29-15-11-14-27-28-19-18-24(5)38-37(28)41-35(27)29;1-17(18-11-7-5-8-12-18)20-15-22(19-13-9-6-10-14-19)24-16-21(20)23(2,3)4;/h6-14,16-23H,1-5H3;5-13,15-17H,1-4H3;/q2*-1;.

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

iridium;2-methyl-8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane has a molecular weight of 1101.95 g/mol, XLogP of 15.25, 9 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-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]germane is sourced from PubChem (CID 156667886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).