4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine

C348H290Ir14N21-21 — CID 157243737

IUPAC4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine
SMILESCC(C)(C)c1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.CC(C)(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccc(-c2cc[c-]c(-c3ccccn3)c2)cc1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1[c-]c(-c2cc(C)c(-c3ccccc3)cn2)cc(C)c1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1cccnc1-c1[c-]cccc1.Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1cnc(-c2[c-]ccc(-c3ccccc3)c2)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cc(-c2ccccc2)ccc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/4C21H20N.4C20H18N.C19H16N.2C18H14N.3C17H12N.C12H10N.6C11H8N.14Ir/c1-21(2,3)19-12-13-22-20(15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;1-21(2,3)19-12-13-20(22-15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;2*1-16(2)13-17-11-12-22-21(14-17)20-10-6-9-19(15-20)18-7-4-3-5-8-18;1-14-9-15(2)11-18(10-14)20-12-16(3)19(13-21-20)17-7-5-4-6-8-17;1-15(2)16-9-11-17(12-10-16)18-6-5-7-19(14-18)20-8-3-4-13-21-20;2*1-15(2)17-11-12-21-20(14-17)19-10-6-9-18(13-19)16-7-4-3-5-8-16;1-14-11-19(20-13-15(14)2)18-10-6-9-17(12-18)16-7-4-3-5-8-16;1-14-10-11-18(19-13-14)17-9-5-8-16(12-17)15-6-3-2-4-7-15;1-14-10-11-19-18(12-14)17-9-5-8-16(13-17)15-6-3-2-4-7-15;2*1-2-7-14(8-3-1)15-9-6-10-16(13-15)17-11-4-5-12-18-17;1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17;1-10-6-5-9-13-12(10)11-7-3-2-4-8-11;6*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;;;;;/h2*4-10,12-15H,1-3H3;2*3-9,11-12,14-16H,13H2,1-2H3;4-10,12-13H,1-3H3;3-6,8-15H,1-2H3;2*3-9,11-15H,1-2H3;3-9,11-13H,1-2H3;2*2-8,10-13H,1H3;2*1-9,11-13H;1-11,13H;2-7,9H,1H3;6*1-6,8-9H;;;;;;;;;;;;;;/q21*-1;;;;;;;;;;;;;;
InChIKeyKVNKTUMENKUOQB-UHFFFAOYSA-N
MW7457.33 g/mol
LogP87.66
Rot. Bonds42

About 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine

4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine (PubChem CID 157243737) has the molecular formula C348H290Ir14N21-21 and a molecular weight of 7457.33 g/mol. Its IUPAC name is 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine.

Molecular Properties

Compound Name4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine
PubChem CID157243737
Molecular FormulaC348H290Ir14N21-21
Molecular Weight7457.33 g/mol
Exact Mass7463.83
IUPAC Name4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine
SMILESCC(C)(C)c1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.CC(C)(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccc(-c2cc[c-]c(-c3ccccn3)c2)cc1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1[c-]c(-c2cc(C)c(-c3ccccc3)cn2)cc(C)c1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1cccnc1-c1[c-]cccc1.Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1cnc(-c2[c-]ccc(-c3ccccc3)c2)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cc(-c2ccccc2)ccc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/4C21H20N.4C20H18N.C19H16N.2C18H14N.3C17H12N.C12H10N.6C11H8N.14Ir/c1-21(2,3)19-12-13-22-20(15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;1-21(2,3)19-12-13-20(22-15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;2*1-16(2)13-17-11-12-22-21(14-17)20-10-6-9-19(15-20)18-7-4-3-5-8-18;1-14-9-15(2)11-18(10-14)20-12-16(3)19(13-21-20)17-7-5-4-6-8-17;1-15(2)16-9-11-17(12-10-16)18-6-5-7-19(14-18)20-8-3-4-13-21-20;2*1-15(2)17-11-12-21-20(14-17)19-10-6-9-18(13-19)16-7-4-3-5-8-16;1-14-11-19(20-13-15(14)2)18-10-6-9-17(12-18)16-7-4-3-5-8-16;1-14-10-11-18(19-13-14)17-9-5-8-16(12-17)15-6-3-2-4-7-15;1-14-10-11-19-18(12-14)17-9-5-8-16(13-17)15-6-3-2-4-7-15;2*1-2-7-14(8-3-1)15-9-6-10-16(13-15)17-11-4-5-12-18-17;1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17;1-10-6-5-9-13-12(10)11-7-3-2-4-8-11;6*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;;;;;/h2*4-10,12-15H,1-3H3;2*3-9,11-12,14-16H,13H2,1-2H3;4-10,12-13H,1-3H3;3-6,8-15H,1-2H3;2*3-9,11-15H,1-2H3;3-9,11-13H,1-2H3;2*2-8,10-13H,1H3;2*1-9,11-13H;1-11,13H;2-7,9H,1H3;6*1-6,8-9H;;;;;;;;;;;;;;/q21*-1;;;;;;;;;;;;;;
InChIKeyKVNKTUMENKUOQB-UHFFFAOYSA-N
XLogP87.66
TPSA270.69 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds42
Heavy Atoms383
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5007457.33
LogP ≤ 587.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine with MolForge

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Related Compounds

4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;pentakis(iridium);5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3-phenylbenzene-6-id-1-yl)-5-propan-2-ylpyridine;bis(2-phenylpyridine)
CID 159954151
2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;pentakis(iridium);2-[3-(3-methylphenyl)benzene-6-id-1-yl]pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-pyridin-2-ylpyridine;2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(4-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine
CID 157363691
4,5-dimethyl-2-phenylpyridine;4-(4-ethylphenyl)-2-phenylpyridine;decakis(iridium);4-(4-methylphenyl)-2-phenylpyridine;3-methyl-2-phenylpyridine;4-methyl-2-phenylpyridine;5-methyl-2-phenylpyridine;4-[4-(2-methylpropyl)phenyl]-2-phenylpyridine;hexakis(4-phenyl-2-phenylpyridine);2-phenyl-4-(4-propan-2-ylphenyl)pyridine;2-phenyl-4-propan-2-ylpyridine;2-phenyl-5-propan-2-ylpyridine;tetrakis(2-phenylpyridine)
CID 158178446
4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tris(iridium);5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine;bis(2-phenylpyridine)
CID 158255265
4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetrakis(iridium);2-(3-phenylbenzene-6-id-1-yl)-5-propan-2-ylpyridine;2-phenylpyridine
CID 158941518
4,5-dimethyl-2-(4-phenylbenzene-6-id-1-yl)pyridine;tetrakis(iridium);5-methyl-2-(4-phenylbenzene-6-id-1-yl)pyridine;4-(1,1,2,2,2-pentadeuterioethyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(4-phenylbenzene-6-id-1-yl)pyridine;tetrakis(2-phenyl-5-(trideuteriomethyl)pyridine)
CID 162098213
5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-[4-(3,5-dimethylphenyl)benzene-6-id-1-yl]pyridine;2,4-dimethyl-6-(3-phenylbenzene-6-id-1-yl)pyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetrakis(iridium)
CID 160525107
pentakis(iridium);bis(4-methyl-2-(4-phenylbenzene-6-id-1-yl)pyridine);5-methyl-2-(4-phenylbenzene-6-id-1-yl)pyridine;4-methyl-5-phenyl-2-phenylpyridine;2-methyl-6-phenylpyridine;2-(4-phenylbenzene-6-id-1-yl)pyridine;tetrakis(2-phenylpyridine)
CID 162204735
4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-[3-(3,5-dimethylphenyl)benzene-6-id-1-yl]pyridine;2-[3-[3,5-di(propan-2-yl)phenyl]benzene-6-id-1-yl]pyridine;4-ethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetrakis(iridium);2-phenylpyridine
CID 159442519
2-(3,5-dimethylbenzene-6-id-1-yl)-4-(2-methylpropyl)quinoline;4-hydroxy-3-phenylpent-3-en-2-one;tetrakis(iridium);bis(4-methyl-5-phenyl-2-phenylpyridine);4-methyl-2-phenylpyridine;4-phenyl-2-phenylpyridine;bis(2-phenylpyridine)
CID 161188747
tetrakis(iridium);4-methyl-2-(4-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(4-phenylbenzene-6-id-1-yl)pyridine;4-methyl-5-phenyl-2-phenylpyridine;2-methyl-6-phenylpyridine;2-(4-phenylbenzene-6-id-1-yl)-4-(trideuteriomethyl)pyridine;tris(2-phenylpyridine)
CID 158811687
4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetrakis(5-tert-butyl-2-phenylpyridine);2-(3H-dibenzofuran-3-id-4-yl)pyridine;pentakis(iridium);5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-[6-(2-methylpropyl)-3H-dibenzofuran-3-id-4-yl]pyridine;5-(2-methylpropyl)-2-phenylpyridine
CID 160554173

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine?
The IUPAC name of 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine (CID 157243737) is 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine.
What is the SMILES notation for 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine?
The canonical SMILES for 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine is CC(C)(C)c1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.CC(C)(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccc(-c2cc[c-]c(-c3ccccn3)c2)cc1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.CC(C)c1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1[c-]c(-c2cc(C)c(-c3ccccc3)cn2)cc(C)c1.Cc1ccc(-c2[c-]ccc(-c3ccccc3)c2)nc1.Cc1cccnc1-c1[c-]cccc1.Cc1ccnc(-c2[c-]ccc(-c3ccccc3)c2)c1.Cc1cnc(-c2[c-]ccc(-c3ccccc3)c2)cc1C.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1cc(-c2ccccc2)ccc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccc(-c2ccccc2)cc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine?
The InChIKey is KVNKTUMENKUOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/4C21H20N.4C20H18N.C19H16N.2C18H14N.3C17H12N.C12H10N.6C11H8N.14Ir/c1-21(2,3)19-12-13-22-20(15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;1-21(2,3)19-12-13-20(22-15-19)18-11-7-10-17(14-18)16-8-5-4-6-9-16;2*1-16(2)13-17-11-12-22-21(14-17)20-10-6-9-19(15-20)18-7-4-3-5-8-18;1-14-9-15(2)11-18(10-14)20-12-16(3)19(13-21-20)17-7-5-4-6-8-17;1-15(2)16-9-11-17(12-10-16)18-6-5-7-19(14-18)20-8-3-4-13-21-20;2*1-15(2)17-11-12-21-20(14-17)19-10-6-9-18(13-19)16-7-4-3-5-8-16;1-14-11-19(20-13-15(14)2)18-10-6-9-17(12-18)16-7-4-3-5-8-16;1-14-10-11-18(19-13-14)17-9-5-8-16(12-17)15-6-3-2-4-7-15;1-14-10-11-19-18(12-14)17-9-5-8-16(13-17)15-6-3-2-4-7-15;2*1-2-7-14(8-3-1)15-9-6-10-16(13-15)17-11-4-5-12-18-17;1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17;1-10-6-5-9-13-12(10)11-7-3-2-4-8-11;6*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;;;;;/h2*4-10,12-15H,1-3H3;2*3-9,11-12,14-16H,13H2,1-2H3;4-10,12-13H,1-3H3;3-6,8-15H,1-2H3;2*3-9,11-15H,1-2H3;3-9,11-13H,1-2H3;2*2-8,10-13H,1H3;2*1-9,11-13H;1-11,13H;2-7,9H,1H3;6*1-6,8-9H;;;;;;;;;;;;;;/q21*-1;;;;;;;;;;;;;;.
What are the key properties of 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine?
4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine has a molecular weight of 7457.33 g/mol, XLogP of 87.66, 42 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-tert-butyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)-4-methyl-5-phenylpyridine;4,5-dimethyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;tetradecakis(iridium);4-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;5-methyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;3-methyl-2-phenylpyridine;bis(4-(2-methylpropyl)-2-(3-phenylbenzene-6-id-1-yl)pyridine);bis(2-(3-phenylbenzene-6-id-1-yl)-4-propan-2-ylpyridine);bis(2-(3-phenylbenzene-6-id-1-yl)pyridine);2-(4-phenylbenzene-6-id-1-yl)pyridine;hexakis(2-phenylpyridine);2-[3-(4-propan-2-ylphenyl)benzene-6-id-1-yl]pyridine is sourced from PubChem (CID 157243737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).