[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane

C159H174Ir4N8Si4-8 — CID 157067548

IUPAC[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
SMILESCC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CC2CCC1CC2.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C(C)C)c(C)c1.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C)c(C)c1.Cc1cccc(-c2ccc(-c3[c-]cccc3)nc2)c1C.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccc(-c2cccc3c2CCCC3)cn1
InChIInChI=1S/C23H30NSi.C22H22N.C21H28NSi.C21H18N.C20H18N.C19H16N.C17H22NSi.C16H20NSi.4Ir/c1-25(2,3)23-16-24-22(19-7-5-4-6-8-19)15-21(23)14-20-13-17-9-11-18(20)12-10-17;1-15(2)20-13-22(18-8-6-5-7-9-18)23-14-21(20)19-11-10-16(3)12-17(19)4;1-16(17-10-8-9-11-17)19-14-20(18-12-6-5-7-13-18)22-15-21(19)23(2,3)4;1-2-8-17(9-3-1)21-14-13-18(15-22-21)20-12-6-10-16-7-4-5-11-19(16)20;1-14-9-10-18(15(2)11-14)19-13-21-20(12-16(19)3)17-7-5-4-6-8-17;1-14-7-6-10-18(15(14)2)17-11-12-19(20-13-17)16-8-4-3-5-9-16;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;/h4-7,15-18,20H,9-14H2,1-3H3;5-8,10-15H,1-4H3;5-7,12,14-17H,8-11H2,1-4H3;1-3,6,8,10,12-15H,4-5,7,11H2;4-7,9-13H,1-3H3;3-8,10-13H,1-2H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;/q8*-1;;;;
InChIKeyAKBYNBRHGMAVME-UHFFFAOYSA-N
MW3078.41 g/mol
LogP39.74
Rot. Bonds23

About [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane

[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane (PubChem CID 157067548) has the molecular formula C159H174Ir4N8Si4-8 and a molecular weight of 3078.41 g/mol. Its IUPAC name is [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane.

Molecular Properties

Compound Name[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
PubChem CID157067548
Molecular FormulaC159H174Ir4N8Si4-8
Molecular Weight3078.41 g/mol
Exact Mass3079.15
IUPAC Name[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane
SMILESCC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CC2CCC1CC2.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C(C)C)c(C)c1.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C)c(C)c1.Cc1cccc(-c2ccc(-c3[c-]cccc3)nc2)c1C.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccc(-c2cccc3c2CCCC3)cn1
InChIInChI=1S/C23H30NSi.C22H22N.C21H28NSi.C21H18N.C20H18N.C19H16N.C17H22NSi.C16H20NSi.4Ir/c1-25(2,3)23-16-24-22(19-7-5-4-6-8-19)15-21(23)14-20-13-17-9-11-18(20)12-10-17;1-15(2)20-13-22(18-8-6-5-7-9-18)23-14-21(20)19-11-10-16(3)12-17(19)4;1-16(17-10-8-9-11-17)19-14-20(18-12-6-5-7-13-18)22-15-21(19)23(2,3)4;1-2-8-17(9-3-1)21-14-13-18(15-22-21)20-12-6-10-16-7-4-5-11-19(16)20;1-14-9-10-18(15(2)11-14)19-13-21-20(12-16(19)3)17-7-5-4-6-8-17;1-14-7-6-10-18(15(14)2)17-11-12-19(20-13-17)16-8-4-3-5-9-16;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;/h4-7,15-18,20H,9-14H2,1-3H3;5-8,10-15H,1-4H3;5-7,12,14-17H,8-11H2,1-4H3;1-3,6,8,10,12-15H,4-5,7,11H2;4-7,9-13H,1-3H3;3-8,10-13H,1-2H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;/q8*-1;;;;
InChIKeyAKBYNBRHGMAVME-UHFFFAOYSA-N
XLogP39.74
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds23
Heavy Atoms175
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003078.41
LogP ≤ 539.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The IUPAC name of [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane (CID 157067548) is [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane.
What is the SMILES notation for [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The canonical SMILES for [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane is CC(C)c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.CC(c1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C)C1CCCC1.CCc1cc(-c2[c-]cccc2)ncc1[Si](C)(C)C.C[Si](C)(C)c1cnc(-c2[c-]cccc2)cc1CC1CC2CCC1CC2.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C(C)C)c(C)c1.Cc1ccc(-c2cnc(-c3[c-]cccc3)cc2C)c(C)c1.Cc1cccc(-c2ccc(-c3[c-]cccc3)nc2)c1C.[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccc(-c2cccc3c2CCCC3)cn1.
What is the InChIKey of [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
The InChIKey is AKBYNBRHGMAVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30NSi.C22H22N.C21H28NSi.C21H18N.C20H18N.C19H16N.C17H22NSi.C16H20NSi.4Ir/c1-25(2,3)23-16-24-22(19-7-5-4-6-8-19)15-21(23)14-20-13-17-9-11-18(20)12-10-17;1-15(2)20-13-22(18-8-6-5-7-9-18)23-14-21(20)19-11-10-16(3)12-17(19)4;1-16(17-10-8-9-11-17)19-14-20(18-12-6-5-7-13-18)22-15-21(19)23(2,3)4;1-2-8-17(9-3-1)21-14-13-18(15-22-21)20-12-6-10-16-7-4-5-11-19(16)20;1-14-9-10-18(15(2)11-14)19-13-21-20(12-16(19)3)17-7-5-4-6-8-17;1-14-7-6-10-18(15(14)2)17-11-12-19(20-13-17)16-8-4-3-5-9-16;1-13(2)15-11-16(14-9-7-6-8-10-14)18-12-17(15)19(3,4)5;1-5-13-11-15(14-9-7-6-8-10-14)17-12-16(13)18(2,3)4;;;;/h4-7,15-18,20H,9-14H2,1-3H3;5-8,10-15H,1-4H3;5-7,12,14-17H,8-11H2,1-4H3;1-3,6,8,10,12-15H,4-5,7,11H2;4-7,9-13H,1-3H3;3-8,10-13H,1-2H3;6-9,11-13H,1-5H3;6-9,11-12H,5H2,1-4H3;;;;/q8*-1;;;;.
What are the key properties of [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane?
[4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane has a molecular weight of 3078.41 g/mol, XLogP of 39.74, 23 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-bicyclo[2.2.2]octanylmethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;[4-(1-cyclopentylethyl)-6-phenyl-3-pyridinyl]-trimethylsilane;5-(2,4-dimethylphenyl)-4-methyl-2-phenylpyridine;5-(2,4-dimethylphenyl)-2-phenyl-4-propan-2-ylpyridine;5-(2,3-dimethylphenyl)-2-phenylpyridine;(4-ethyl-6-phenyl-3-pyridinyl)-trimethylsilane;tetrakis(iridium);2-phenyl-5-(5,6,7,8-tetrahydronaphthalen-1-yl)pyridine;trimethyl-(6-phenyl-4-propan-2-yl-3-pyridinyl)silane is sourced from PubChem (CID 157067548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).