[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane

C140H130Ir4N8O4Si4-8 — CID 157082009

IUPAC[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane
SMILESCC(C)c1ccc(-c2[c-]cc([Si](C)(C)C)c3c2oc2ccccc23)nc1.C[Si](C)(C)c1ccc2c(c1)oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C23H22NOSi.C23H24NOSi.4C12H10N.4Ir/c1-26(2,3)21-9-5-7-18-17-6-4-8-19(22(17)25-23(18)21)20-13-12-16(14-24-20)15-10-11-15;1-26(2,3)17-10-11-18-19-5-4-6-20(23(19)25-22(18)13-17)21-12-9-16(14-24-21)15-7-8-15;1-26(2,3)17-10-12-22-20(13-17)18-5-4-6-19(23(18)25-22)21-11-9-16(14-24-21)15-7-8-15;1-15(2)16-10-12-19(24-14-16)17-11-13-21(26(3,4)5)22-18-8-6-7-9-20(18)25-23(17)22;4*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;;;;/h4-7,9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;6-10,12-15H,1-5H3;4*2-5,7-9H,1H3;;;;/q8*-1;;;;/i;;;;4*1D3;;;;
InChIKeyWMZLFEGDQSTJSD-ZCGQUQJASA-N
MW2881.92 g/mol
LogP35.15
Rot. Bonds20

About [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane

[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane (PubChem CID 157082009) has the molecular formula C140H130Ir4N8O4Si4-8 and a molecular weight of 2881.92 g/mol. Its IUPAC name is [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane.

Molecular Properties

Compound Name[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane
PubChem CID157082009
Molecular FormulaC140H130Ir4N8O4Si4-8
Molecular Weight2881.92 g/mol
Exact Mass2882.86
IUPAC Name[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane
SMILESCC(C)c1ccc(-c2[c-]cc([Si](C)(C)C)c3c2oc2ccccc23)nc1.C[Si](C)(C)c1ccc2c(c1)oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C23H22NOSi.C23H24NOSi.4C12H10N.4Ir/c1-26(2,3)21-9-5-7-18-17-6-4-8-19(22(17)25-23(18)21)20-13-12-16(14-24-20)15-10-11-15;1-26(2,3)17-10-11-18-19-5-4-6-20(23(19)25-22(18)13-17)21-12-9-16(14-24-21)15-7-8-15;1-26(2,3)17-10-12-22-20(13-17)18-5-4-6-19(23(18)25-22)21-11-9-16(14-24-21)15-7-8-15;1-15(2)16-10-12-19(24-14-16)17-11-13-21(26(3,4)5)22-18-8-6-7-9-20(18)25-23(17)22;4*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;;;;/h4-7,9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;6-10,12-15H,1-5H3;4*2-5,7-9H,1H3;;;;/q8*-1;;;;/i;;;;4*1D3;;;;
InChIKeyWMZLFEGDQSTJSD-ZCGQUQJASA-N
XLogP35.15
TPSA155.68 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds20
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002881.92
LogP ≤ 535.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane with MolForge

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Related Compounds

2-[3-Dibenzofuran-4-yl-4-[2-[3-[2-[2-dibenzofuran-4-yl-4-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)-2-pyridinyl]benzene-5-id-1-yl]phenyl]-5-[2-(2-phenyl-4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]benzene-6-id-1-yl]-5-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine;iridium(3+)
CID 153319870
2-[4-[2-[3,5-Bis[2-(2-dibenzofuran-4-yl-4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]-3-phenylbenzene-6-id-1-yl]-4-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine;iridium(3+)
CID 153319985
iridium;iridium(3+);methanol;2-(6-methyl-3H-dibenzofuran-3-id-4-yl)pyridine;2-(6-methyldibenzofuran-4-yl)pyridine;tris(2-phenylpyridine);trifluoromethanesulfonate
CID 157068741
2-(3H-dibenzofuran-3-id-4-yl)-4-propan-2-ylpyridine;2-dibenzofuran-4-yl-4-propan-2-ylpyridine;bis(iridium(3+));methanol;tetrakis(2-phenyl-5-propan-2-ylpyridine);trifluoromethanesulfonate
CID 157195204
2-[4-[2-[3,5-Bis[2-(2-dibenzofuran-4-yl-4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]-3-phenylbenzene-6-id-1-yl]-4-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine;2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]-3-phenylbenzene-6-id-1-yl]-4-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridine;4-tert-butyl-2-[4-[2-[3-[2-[4-(5-tert-butyl-2-pyridinyl)benzene-5-id-1-yl]phenyl]-5-[2-(2-phenyl-4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]benzene-6-id-1-yl]pyridine;tris(iridium(3+))
CID 157239422
iridium;iridium(3+);methanol;tris(2-phenylpyridine);2-(6-propan-2-yl-3H-dibenzofuran-3-id-4-yl)pyridine;2-(6-propan-2-yldibenzofuran-4-yl)pyridine;trifluoromethanesulfonate
CID 157257079
2-(3H-dibenzofuran-3-id-4-yl)-4-propan-2-ylpyridine;2-dibenzofuran-4-yl-4-propan-2-ylpyridine;bis(iridium(3+));methanol;tetrakis(2-methyl-6-phenylpyridine);trifluoromethanesulfonate
CID 157329600
3H-dibenzofuran-3-ide;2-dibenzofuran-4-yl-4-(1,1,1-trideuteriopropan-2-yl)pyridine;iridium;iridium(3+);methanol;tetrakis(2-phenylpyridine);4-(1,1,1-trideuteriopropan-2-yl)pyridine;trifluoromethanesulfonic acid
CID 157345933
2-(3H-dibenzofuran-3-id-4-yl)-4-propan-2-ylpyridine;2-dibenzofuran-4-yl-4-propan-2-ylpyridine;bis(iridium(3+));methanol;tetrakis(5-methyl-2-phenylpyridine);trifluoromethanesulfonate
CID 157423508
2-(3H-dibenzofuran-3-id-4-yl)-4-ethylpyridine;2-dibenzofuran-4-yl-4-ethylpyridine;bis(iridium(3+));methanol;tetrakis(2-phenylpyridine);trifluoromethanesulfonate
CID 157444017
[6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;(6-dibenzofuran-2-yl-3-pyridinyl)-trimethylsilane;ethanol;iridium;iridium(3+);methanol;trifluoromethanesulfonic acid;tetrakis(trimethyl-(6-phenyl-3-pyridinyl)silane)
CID 157730818
Bis(iridium);methanol;bis(2-methyl-6-phenylpyridine);3-phenyl-[1]benzofuro[3,2-c]pyridine;3-phenyl-[1]benzofuro[3,2-c]pyridine;trifluoromethanesulfonate
CID 157759369

Frequently Asked Questions

What is the IUPAC name of [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane?
The IUPAC name of [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane (CID 157082009) is [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane.
What is the SMILES notation for [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane?
The canonical SMILES for [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane is CC(C)c1ccc(-c2[c-]cc([Si](C)(C)C)c3c2oc2ccccc23)nc1.C[Si](C)(C)c1ccc2c(c1)oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.C[Si](C)(C)c1ccc2oc3c(-c4ccc(C5CC5)cn4)[c-]ccc3c2c1.C[Si](C)(C)c1cccc2c1oc1c(-c3ccc(C4CC4)cn3)[c-]ccc12.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[2H]C([2H])([2H])c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane?
The InChIKey is WMZLFEGDQSTJSD-ZCGQUQJASA-N. The full InChI is InChI=1S/3C23H22NOSi.C23H24NOSi.4C12H10N.4Ir/c1-26(2,3)21-9-5-7-18-17-6-4-8-19(22(17)25-23(18)21)20-13-12-16(14-24-20)15-10-11-15;1-26(2,3)17-10-11-18-19-5-4-6-20(23(19)25-22(18)13-17)21-12-9-16(14-24-21)15-7-8-15;1-26(2,3)17-10-12-22-20(13-17)18-5-4-6-19(23(18)25-22)21-11-9-16(14-24-21)15-7-8-15;1-15(2)16-10-12-19(24-14-16)17-11-13-21(26(3,4)5)22-18-8-6-7-9-20(18)25-23(17)22;4*1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;;;;/h4-7,9,12-15H,10-11H2,1-3H3;2*4-5,9-15H,7-8H2,1-3H3;6-10,12-15H,1-5H3;4*2-5,7-9H,1H3;;;;/q8*-1;;;;/i;;;;4*1D3;;;;.
What are the key properties of [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane?
[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane has a molecular weight of 2881.92 g/mol, XLogP of 35.15, 20 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-2-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-3-yl]-trimethylsilane;[6-(5-cyclopropyl-2-pyridinyl)-7H-dibenzofuran-7-id-4-yl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine);trimethyl-[4-(5-propan-2-yl-2-pyridinyl)-3H-dibenzofuran-3-id-1-yl]silane is sourced from PubChem (CID 157082009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).