8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium

C58H55FGeIrN4O-2 — CID 155612031

About 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium

8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium (PubChem CID 155612031) has the molecular formula C58H55FGeIrN4O-2 and a molecular weight of 1107.93 g/mol. Its IUPAC name is 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium.

Molecular Properties

• Compound Name: 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium
• PubChem CID: 155612031
• Molecular Formula: C58H55FGeIrN4O-2
• Molecular Weight: 1107.93 g/mol
• Exact Mass: 1109.32
• IUPAC Name: 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium
• SMILES: Cc1cc[c-]c(-c2cc(CC(C)C)c([Ge](C)(C)C)cn2)c1F.[Ir].[c-]1ccc2c(oc3nc(-c4ccc(-c5ccccc5)nc4-c4ccccc4)ccc32)c1-c1cc(CC2CCCC2)ccn1
• InChI: InChI=1S/C39H30N3O.C19H25FGeN.Ir/c1-3-12-28(13-4-1)34-20-19-32(37(41-34)29-14-5-2-6-15-29)35-21-18-31-30-16-9-17-33(38(30)43-39(31)42-35)36-25-27(22-23-40-36)24-26-10-7-8-11-26;1-13(2)10-15-11-18(22-12-17(15)21(4,5)6)16-9-7-8-14(3)19(16)20;/h1-6,9,12-16,18-23,25-26H,7-8,10-11,24H2;7-8,11-13H,10H2,1-6H3;/q2*-1
• InChIKey: DEWFLQVUGXOAEB-UHFFFAOYSA-N
• XLogP: 14.71
• TPSA: 64.70 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1107.93
LogP ≤ 5	14.71
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 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium?

The IUPAC name of 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium (CID 155612031) is 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium.

What is the SMILES notation for 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium?

The canonical SMILES for 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium is Cc1cc[c-]c(-c2cc(CC(C)C)c([Ge](C)(C)C)cn2)c1F.[Ir].[c-]1ccc2c(oc3nc(-c4ccc(-c5ccccc5)nc4-c4ccccc4)ccc32)c1-c1cc(CC2CCCC2)ccn1.

What is the InChIKey of 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium?

The InChIKey is DEWFLQVUGXOAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H30N3O.C19H25FGeN.Ir/c1-3-12-28(13-4-1)34-20-19-32(37(41-34)29-14-5-2-6-15-29)35-21-18-31-30-16-9-17-33(38(30)43-39(31)42-35)36-25-27(22-23-40-36)24-26-10-7-8-11-26;1-13(2)10-15-11-18(22-12-17(15)21(4,5)6)16-9-7-8-14(3)19(16)20;/h1-6,9,12-16,18-23,25-26H,7-8,10-11,24H2;7-8,11-13H,10H2,1-6H3;/q2*-1;.

What are the key properties of 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium?

8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium has a molecular weight of 1107.93 g/mol, XLogP of 14.71, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-(2,6-diphenyl-3-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;[6-(2-fluoro-3-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylgermane;iridium is sourced from PubChem (CID 155612031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).