[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane

C164H146Ir5N10OS4Si5-10 — CID 161453629

IUPAC[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane
SMILESCC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CCCCC3)ccn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4ccccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4ccccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C26H28NOSi.4C20H18NSSi.C14H14N.4C11H8N.5Ir/c1-29(2,3)24-14-13-20(26-25(24)21-11-7-8-12-23(21)28-26)22-17-19(15-16-27-22)18-9-5-4-6-10-18;1-23(2,3)18-12-7-9-15-14-8-6-10-16(19(14)22-20(15)18)17-11-4-5-13-21-17;1-23(2,3)18-12-7-11-17-19(18)15-9-6-8-14(20(15)22-17)16-10-4-5-13-21-16;1-23(2,3)14-10-11-15-16-7-6-8-17(18-9-4-5-12-21-18)20(16)22-19(15)13-14;1-23(2,3)14-10-11-19-17(13-14)15-7-6-8-16(20(15)22-19)18-9-4-5-12-21-18;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;/h7-8,11-12,14-18H,4-6,9-10H2,1-3H3;4-9,11-13H,1-3H3;3*4-7,9-13H,1-3H3;3-6,8-11H,1-2H3;4*1-6,8-9H;;;;;/q10*-1;;;;;
InChIKeyZUTQWPGFDFKOCD-UHFFFAOYSA-N
MW3502.82 g/mol
LogP42.74
Rot. Bonds17

About [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane

[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane (PubChem CID 161453629) has the molecular formula C164H146Ir5N10OS4Si5-10 and a molecular weight of 3502.82 g/mol. Its IUPAC name is [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane.

Molecular Properties

Compound Name[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane
PubChem CID161453629
Molecular FormulaC164H146Ir5N10OS4Si5-10
Molecular Weight3502.82 g/mol
Exact Mass3503.76
IUPAC Name[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane
SMILESCC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CCCCC3)ccn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4ccccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4ccccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C26H28NOSi.4C20H18NSSi.C14H14N.4C11H8N.5Ir/c1-29(2,3)24-14-13-20(26-25(24)21-11-7-8-12-23(21)28-26)22-17-19(15-16-27-22)18-9-5-4-6-10-18;1-23(2,3)18-12-7-9-15-14-8-6-10-16(19(14)22-20(15)18)17-11-4-5-13-21-17;1-23(2,3)18-12-7-11-17-19(18)15-9-6-8-14(20(15)22-17)16-10-4-5-13-21-16;1-23(2,3)14-10-11-15-16-7-6-8-17(18-9-4-5-12-21-18)20(16)22-19(15)13-14;1-23(2,3)14-10-11-19-17(13-14)15-7-6-8-16(20(15)22-19)18-9-4-5-12-21-18;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;/h7-8,11-12,14-18H,4-6,9-10H2,1-3H3;4-9,11-13H,1-3H3;3*4-7,9-13H,1-3H3;3-6,8-11H,1-2H3;4*1-6,8-9H;;;;;/q10*-1;;;;;
InChIKeyZUTQWPGFDFKOCD-UHFFFAOYSA-N
XLogP42.74
TPSA142.04 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds17
Heavy Atoms189
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003502.82
LogP ≤ 542.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane?
The IUPAC name of [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane (CID 161453629) is [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane.
What is the SMILES notation for [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane?
The canonical SMILES for [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane is CC(C)c1ccc(-c2[c-]cccc2)nc1.C[Si](C)(C)c1c[c-]c(-c2cc(C3CCCCC3)ccn2)c2oc3ccccc3c12.C[Si](C)(C)c1ccc2c(c1)sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1ccc2sc3c(-c4ccccn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1sc1c(-c3ccccn3)[c-]ccc12.C[Si](C)(C)c1cccc2sc3c(-c4ccccn4)[c-]ccc3c12.[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane?
The InChIKey is ZUTQWPGFDFKOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28NOSi.4C20H18NSSi.C14H14N.4C11H8N.5Ir/c1-29(2,3)24-14-13-20(26-25(24)21-11-7-8-12-23(21)28-26)22-17-19(15-16-27-22)18-9-5-4-6-10-18;1-23(2,3)18-12-7-9-15-14-8-6-10-16(19(14)22-20(15)18)17-11-4-5-13-21-17;1-23(2,3)18-12-7-11-17-19(18)15-9-6-8-14(20(15)22-17)16-10-4-5-13-21-16;1-23(2,3)14-10-11-15-16-7-6-8-17(18-9-4-5-12-21-18)20(16)22-19(15)13-14;1-23(2,3)14-10-11-19-17(13-14)15-7-6-8-16(20(15)22-19)18-9-4-5-12-21-18;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;/h7-8,11-12,14-18H,4-6,9-10H2,1-3H3;4-9,11-13H,1-3H3;3*4-7,9-13H,1-3H3;3-6,8-11H,1-2H3;4*1-6,8-9H;;;;;/q10*-1;;;;;.
What are the key properties of [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane?
[4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane has a molecular weight of 3502.82 g/mol, XLogP of 42.74, 17 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-cyclohexyl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]-trimethylsilane;pentakis(iridium);2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine);trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-1-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-2-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-3-yl)silane;trimethyl-(6-pyridin-2-yl-7H-dibenzothiophen-7-id-4-yl)silane is sourced from PubChem (CID 161453629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).