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

C140H128Ir4N8Si-8 — CID 163634361

IUPACtetrakis(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
SMILESC[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir].[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1
InChIInChI=1S/C19H22N.5C18H14N.C17H20N.C14H16NSi.4Ir/c1-15-14-20-19(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;4*1-2-7-15(8-3-1)13-16-9-6-10-17(14-16)18-11-4-5-12-19-18;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;;;;/h3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;4*1-9,11-12,14H,13H2;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyNCBOIMGTWCGYGE-UHFFFAOYSA-N
MW2719.57 g/mol
LogP33.51
Rot. Bonds22

About 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

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 (PubChem CID 163634361) has the molecular formula C140H128Ir4N8Si-8 and a molecular weight of 2719.57 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Nametetrakis(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
PubChem CID163634361
Molecular FormulaC140H128Ir4N8Si-8
Molecular Weight2719.57 g/mol
Exact Mass2720.86
IUPAC Nametetrakis(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
SMILESC[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir].[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1
InChIInChI=1S/C19H22N.5C18H14N.C17H20N.C14H16NSi.4Ir/c1-15-14-20-19(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;4*1-2-7-15(8-3-1)13-16-9-6-10-17(14-16)18-11-4-5-12-19-18;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;;;;/h3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;4*1-9,11-12,14H,13H2;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;
InChIKeyNCBOIMGTWCGYGE-UHFFFAOYSA-N
XLogP33.51
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds22
Heavy Atoms153
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002719.57
LogP ≤ 533.51
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 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 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

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
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
2-(3-benzylbenzene-6-id-1-yl)-4-propan-2-ylpyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;iridium
CID 162710050
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;tetrakis(2-[3-(2-phenylpropan-2-yl)benzene-6-id-1-yl]pyridine)
CID 163932657
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-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;iridium;2-(4-methylbenzene-6-id-1-yl)-4-(2-phenylpropan-2-yl)pyridine
CID 162708967
2-[3-[dideuterio(phenyl)methyl]-4-phenylbenzene-6-id-1-yl]pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 162709659
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-benzyl-2-(7-fluoro-3H-dibenzothiophen-3-id-2-yl)pyridine;4-(cyclohexylmethyl)-5-methyl-2-phenylpyridine;iridium
CID 162709802
4-(cyclopentylmethyl)-2-(7-fluoro-3H-dibenzofuran-3-id-2-yl)pyridine;iridium;trimethyl-(6-phenyl-3-pyridinyl)silane
CID 164712406
iridium;2-(3H-phenanthren-3-id-2-yl)pyridine;trimethyl-[6-(4-methyl-3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane
CID 164792166
2-(3-benzyl-4-methylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;iridium;5-methyl-2-phenylpyridine
CID 162709141

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is C[Si](C)(C)c1ccc(-c2[c-]cccc2)nc1.Cc1c[c-]c(-c2cc(C)c(CC(C)C)cn2)cc1.Cc1cnc(-c2[c-]cccc2)cc1-c1ccccc1.Cc1cnc(-c2[c-]cccc2)cc1CC1CCCCC1.[Ir].[Ir].[Ir].[Ir].[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.[c-]1ccc(Cc2ccccc2)cc1-c1ccccn1.
What is the InChIKey of 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?
The InChIKey is NCBOIMGTWCGYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N.5C18H14N.C17H20N.C14H16NSi.4Ir/c1-15-14-20-19(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;4*1-2-7-15(8-3-1)13-16-9-6-10-17(14-16)18-11-4-5-12-19-18;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;;;;/h3,6-7,10,13-14,16H,2,4-5,8-9,12H2,1H3;2-10,12-13H,1H3;4*1-9,11-12,14H,13H2;5-7,10-12H,9H2,1-4H3;4-7,9-11H,1-3H3;;;;/q8*-1;;;;.
What are the key properties of 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?
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 has a molecular weight of 2719.57 g/mol, XLogP of 33.51, 22 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 163634361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).