8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide

C172H169Ir5N15O5Si5-10 — CID 163593436

IUPAC8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide
SMILESCC(C)(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ncccc32)c1-c1ccccn1
InChIInChI=1S/2C20H17N2O.C19H15N2O.C17H11N2O.C16H9N2O.5C16H20NSi.5Ir/c1-20(2,3)13-9-11-21-17(12-13)16-7-4-6-14-15-8-5-10-22-19(15)23-18(14)16;1-13(2)11-14-8-10-21-18(12-14)17-6-3-5-15-16-7-4-9-22-20(16)23-19(15)17;1-12(2)13-8-10-20-17(11-13)16-6-3-5-14-15-7-4-9-21-19(15)22-18(14)16;1-11-7-9-18-15(10-11)14-5-2-4-12-13-6-3-8-19-17(13)20-16(12)14;1-2-9-17-14(8-1)13-6-3-5-11-12-7-4-10-18-16(12)19-15(11)13;5*1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h4-6,8-12H,1-3H3;3-5,7-10,12-13H,11H2,1-2H3;3-5,7-12H,1-2H3;2-4,6-10H,1H3;1-5,7-10H;5*6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;
InChIKeyMSMWBEDSFJOBCS-UHFFFAOYSA-N
MW3627.86 g/mol
LogP41.41
Rot. Bonds23

About 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide

8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide (PubChem CID 163593436) has the molecular formula C172H169Ir5N15O5Si5-10 and a molecular weight of 3627.86 g/mol. Its IUPAC name is 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide.

Molecular Properties

Compound Name8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide
PubChem CID163593436
Molecular FormulaC172H169Ir5N15O5Si5-10
Molecular Weight3627.86 g/mol
Exact Mass3629.05
IUPAC Name8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide
SMILESCC(C)(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ncccc32)c1-c1ccccn1
InChIInChI=1S/2C20H17N2O.C19H15N2O.C17H11N2O.C16H9N2O.5C16H20NSi.5Ir/c1-20(2,3)13-9-11-21-17(12-13)16-7-4-6-14-15-8-5-10-22-19(15)23-18(14)16;1-13(2)11-14-8-10-21-18(12-14)17-6-3-5-15-16-7-4-9-22-20(16)23-19(15)17;1-12(2)13-8-10-20-17(11-13)16-6-3-5-14-15-7-4-9-21-19(15)22-18(14)16;1-11-7-9-18-15(10-11)14-5-2-4-12-13-6-3-8-19-17(13)20-16(12)14;1-2-9-17-14(8-1)13-6-3-5-11-12-7-4-10-18-16(12)19-15(11)13;5*1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h4-6,8-12H,1-3H3;3-5,7-10,12-13H,11H2,1-2H3;3-5,7-12H,1-2H3;2-4,6-10H,1H3;1-5,7-10H;5*6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;
InChIKeyMSMWBEDSFJOBCS-UHFFFAOYSA-N
XLogP41.41
TPSA259.05 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds23
Heavy Atoms202
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003627.86
LogP ≤ 541.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide?
The IUPAC name of 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide (CID 163593436) is 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide.
What is the SMILES notation for 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide?
The canonical SMILES for 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide is CC(C)(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CC(C)c1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.Cc1ccnc(-c2[c-]ccc3c2oc2ncccc23)c1.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2c(oc3ncccc32)c1-c1ccccn1.
What is the InChIKey of 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide?
The InChIKey is MSMWBEDSFJOBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H17N2O.C19H15N2O.C17H11N2O.C16H9N2O.5C16H20NSi.5Ir/c1-20(2,3)13-9-11-21-17(12-13)16-7-4-6-14-15-8-5-10-22-19(15)23-18(14)16;1-13(2)11-14-8-10-21-18(12-14)17-6-3-5-15-16-7-4-9-22-20(16)23-19(15)17;1-12(2)13-8-10-20-17(11-13)16-6-3-5-14-15-7-4-9-21-19(15)22-18(14)16;1-11-7-9-18-15(10-11)14-5-2-4-12-13-6-3-8-19-17(13)20-16(12)14;1-2-9-17-14(8-1)13-6-3-5-11-12-7-4-10-18-16(12)19-15(11)13;5*1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;;/h4-6,8-12H,1-3H3;3-5,7-10,12-13H,11H2,1-2H3;3-5,7-12H,1-2H3;2-4,6-10H,1H3;1-5,7-10H;5*6-9,11-12H,5H2,1-4H3;;;;;/q10*-1;;;;;.
What are the key properties of 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide?
8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide has a molecular weight of 3627.86 g/mol, XLogP of 41.41, 23 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-tert-butyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;pentakis((4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane);pentakis(iridium);8-[4-(2-methylpropyl)-2-pyridinyl]-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-methyl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-(4-propan-2-yl-2-pyridinyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-pyridin-2-yl-7H-[1]benzofuro[2,3-b]pyridin-7-ide is sourced from PubChem (CID 163593436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).