tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane

C168H144Ir4N8O3SSi-8 — CID 163503471

IUPACtris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
SMILESC[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cc(-c2[c-]cc3sc4ccccc4c3c2)ncc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C25H18NO.C25H18NS.C19H22N.C18H14N.C17H20N.C14H16NSi.4Ir/c3*1-17-16-26-23(15-20(17)13-18-7-3-2-4-8-18)19-11-12-25-22(14-19)21-9-5-6-10-24(21)27-25;1-17-13-23(26-16-20(17)14-18-7-3-2-4-8-18)19-11-12-25-22(15-19)21-9-5-6-10-24(21)27-25;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h3*2-10,12,14-16H,13H2,1H3;2-10,12-13,15-16H,14H2,1H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyDDEXBODFDCQTPA-UHFFFAOYSA-N
MW3152.07 g/mol
LogP42.81
Rot. Bonds22

About tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane

tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane (PubChem CID 163503471) has the molecular formula C168H144Ir4N8O3SSi-8 and a molecular weight of 3152.07 g/mol. Its IUPAC name is tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane.

Molecular Properties

Compound Nametris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
PubChem CID163503471
Molecular FormulaC168H144Ir4N8O3SSi-8
Molecular Weight3152.07 g/mol
Exact Mass3152.94
IUPAC Nametris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
SMILESC[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cc(-c2[c-]cc3sc4ccccc4c3c2)ncc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/3C25H18NO.C25H18NS.C19H22N.C18H14N.C17H20N.C14H16NSi.4Ir/c3*1-17-16-26-23(15-20(17)13-18-7-3-2-4-8-18)19-11-12-25-22(14-19)21-9-5-6-10-24(21)27-25;1-17-13-23(26-16-20(17)14-18-7-3-2-4-8-18)19-11-12-25-22(15-19)21-9-5-6-10-24(21)27-25;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h3*2-10,12,14-16H,13H2,1H3;2-10,12-13,15-16H,14H2,1H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyDDEXBODFDCQTPA-UHFFFAOYSA-N
XLogP42.81
TPSA142.54 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds22
Heavy Atoms185
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003152.07
LogP ≤ 542.81
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 tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tetrakis(2-(3-benzylbenzene-6-id-1-yl)pyridine);4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 163634361
4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tris(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;2-(9H-naphtho[2,1-b][1]benzofuran-9-id-10-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(9H-naphtho[1,2-b][1]benzothiol-9-id-8-yl)-4-(2-phenylpropan-2-yl)pyridine;2-(6-phenyl-3H-dibenzofuran-3-id-2-yl)-4-(2-phenylpropan-2-yl)pyridine
CID 163655178
4-benzyl-2-(3H-dibenzofuran-3-id-4-yl)-5-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;iridium
CID 162707719
[4-butan-2-yl-6-(3H-dibenzothiophen-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[4-cyclopentyl-6-(3H-dibenzofuran-3-id-2-yl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzofuran-3-id-2-yl)-4-(2-methylpropyl)-3-pyridinyl]-trimethylsilane;[6-(3H-dibenzothiophen-3-id-2-yl)-4-propan-2-yl-3-pyridinyl]-trimethylsilane;tetrakis(iridium);tetrakis(2-phenylpyridine)
CID 158343238
4-benzyl-2-(7-fluoro-3H-dibenzothiophen-3-id-2-yl)pyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;iridium
CID 162709802
4-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-3H-[1]benzofuro[3,2-c]pyridin-3-ide;iridium;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane
CID 155610503
bis(4-benzyl-5-methyl-2-phenylpyridine);4-benzyl-5-phenyl-2-phenylpyridine;tetrakis(iridium);3-methyl-2-phenyl-5-(2-phenylpropan-2-yl)pyridine;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane;trimethyl-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]silane;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane;trimethyl-[6-(3-phenylbenzene-6-id-1-yl)-4-propan-2-yl-3-pyridinyl]silane
CID 163931023
4-(cyclopentylmethyl)-2-(7-fluoro-3H-dibenzofuran-3-id-2-yl)pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 164712406
2-(3-benzyl-4-methylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;iridium;5-methyl-2-phenylpyridine
CID 162709141
2-(3-benzylbenzene-6-id-1-yl)-4-(2,2-dimethylpropyl)pyridine;2-(3-benzylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;2-(3-benzylbenzene-6-id-1-yl)-5-methyl-4-phenylpyridine;2-(3-benzylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)-4-(2-methylpropyl)pyridine;5-methyl-2-(4-methylbenzene-6-id-1-yl)pyridine;5-methyl-2-phenylpyridine
CID 163553179
4-(cyclohexylmethyl)-2-(1-phenyl-3H-dibenzofuran-3-id-4-yl)pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 166578804
iridium;4-phenyl-2-(8-phenyl-3H-dibenzofuran-3-id-2-yl)-5-(trideuteriomethyl)pyridine;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 166578426

Frequently Asked Questions

What is the IUPAC name of tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane?
The IUPAC name of tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane (CID 163503471) is tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane.
What is the SMILES notation for tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane?
The canonical SMILES for tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane is C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cc(-c2[c-]cc3sc4ccccc4c3c2)ncc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cc3oc4ccccc4c3c2)cc1Cc1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane?
The InChIKey is DDEXBODFDCQTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/3C25H18NO.C25H18NS.C19H22N.C18H14N.C17H20N.C14H16NSi.4Ir/c3*1-17-16-26-23(15-20(17)13-18-7-3-2-4-8-18)19-11-12-25-22(14-19)21-9-5-6-10-24(21)27-25;1-17-13-23(26-16-20(17)14-18-7-3-2-4-8-18)19-11-12-25-22(15-19)21-9-5-6-10-24(21)27-25;1-15-14-20-19(17-10-6-3-7-11-17)13-18(15)12-16-8-4-2-5-9-16;1-14-13-19-18(16-10-6-3-7-11-16)12-17(14)15-8-4-2-5-9-15;1-12(2)9-16-11-18-17(10-14(16)4)15-7-5-13(3)6-8-15;1-16(2,3)13-9-10-14(15-11-13)12-7-5-4-6-8-12;;;;/h3*2-10,12,14-16H,13H2,1H3;2-10,12-13,15-16H,14H2,1H3;3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;.
What are the key properties of tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane?
tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane has a molecular weight of 3152.07 g/mol, XLogP of 42.81, 22 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for tris(4-benzyl-2-(3H-dibenzofuran-3-id-2-yl)-5-methylpyridine);5-benzyl-2-(3H-dibenzothiophen-3-id-2-yl)-4-methylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;tetrakis(iridium);4-methyl-2-(4-methylbenzene-6-id-1-yl)-5-(2-methylpropyl)pyridine;5-methyl-4-phenyl-2-phenylpyridine;trimethyl-(6-phenyl-3-pyridinyl)silane is sourced from PubChem (CID 163503471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).