[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline

C265H225ClIr10N17O16-13 — CID 159059184

IUPAC[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline
SMILESCC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.COc1cc[c-]c(-c2cc(C)c(Cl)nn2)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1C.Cc1c[c-]c(-c2ncccc2C#N)c2ccccc12.Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.Cc1cccnc1-c1[c-]ccc2ccccc12.N#Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.N#Cc1cccnc1-c1[c-]ccc2ccccc12.[C-](=C/c1ccc2ccccc2n1)\c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2ccccc2c1-c1ncccc1-c1ccccc1.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C24H20N.C23H18N.C22H20NO.C21H14N.C18H11N2.C18H14N.C17H11N2.C17H12N.C16H9N2.C16H12N.C15H10N.C12H10ClN2O.C11H8N.7C5H8O2.10Ir/c1-16-13-22(14-17(2)18(16)3)24-12-10-21-15-20(9-11-23(21)25-24)19-7-5-4-6-8-19;1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18;1-22(2,3)19-12-9-16(10-13-19)20-14-11-18(15-23-20)21(24)17-7-5-4-6-8-17;1-2-8-17(9-3-1)19-14-7-15-22-21(19)20-13-6-11-16-10-4-5-12-18(16)20;19-11-14-4-2-10-20-18(14)16-9-8-13-7-6-12-3-1-5-15(16)17(12)13;1-12-4-3-11-19-18(12)16-10-9-14-8-7-13-5-2-6-15(16)17(13)14;1-12-8-9-16(15-7-3-2-6-14(12)15)17-13(11-18)5-4-10-19-17;1-2-6-14(7-3-1)10-12-16-13-11-15-8-4-5-9-17(15)18-16;17-11-13-7-4-10-18-16(13)15-9-3-6-12-5-1-2-8-14(12)15;1-12-6-5-11-17-16(12)15-10-4-8-13-7-2-3-9-14(13)15;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;1-8-6-11(14-15-12(8)13)9-4-3-5-10(7-9)16-2;1-2-6-10(7-3-1)11-8-4-5-9-12-11;7*1-4(6)3-5(2)7;;;;;;;;;;/h4-13,15H,1-3H3;3-13,15H,1-2H3;4-9,11-15H,1-3H3;1-12,14-15H;1-5,8,10H,6-7H2;2-6,9,11H,7-8H2,1H3;2-8,10H,1H3;1-9,11-13H;1-8,10H;2-9,11H,1H3;1-6,8-11H;3,5-7H,1-2H3;1-6,8-9H;7*3,6H,1-2H3;;;;;;;;;;/q13*-1;;;;;;;;;;;;;;;;;
InChIKeyOAEMWSJUNKRMIO-UHFFFAOYSA-N
MW5861.44 g/mol
LogP62.47
Rot. Bonds27

About [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline

[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline (PubChem CID 159059184) has the molecular formula C265H225ClIr10N17O16-13 and a molecular weight of 5861.44 g/mol. Its IUPAC name is [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline.

Molecular Properties

Compound Name[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline
PubChem CID159059184
Molecular FormulaC265H225ClIr10N17O16-13
Molecular Weight5861.44 g/mol
Exact Mass5865.34
IUPAC Name[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline
SMILESCC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.COc1cc[c-]c(-c2cc(C)c(Cl)nn2)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1C.Cc1c[c-]c(-c2ncccc2C#N)c2ccccc12.Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.Cc1cccnc1-c1[c-]ccc2ccccc12.N#Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.N#Cc1cccnc1-c1[c-]ccc2ccccc12.[C-](=C/c1ccc2ccccc2n1)\c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2ccccc2c1-c1ncccc1-c1ccccc1.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C24H20N.C23H18N.C22H20NO.C21H14N.C18H11N2.C18H14N.C17H11N2.C17H12N.C16H9N2.C16H12N.C15H10N.C12H10ClN2O.C11H8N.7C5H8O2.10Ir/c1-16-13-22(14-17(2)18(16)3)24-12-10-21-15-20(9-11-23(21)25-24)19-7-5-4-6-8-19;1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18;1-22(2,3)19-12-9-16(10-13-19)20-14-11-18(15-23-20)21(24)17-7-5-4-6-8-17;1-2-8-17(9-3-1)19-14-7-15-22-21(19)20-13-6-11-16-10-4-5-12-18(16)20;19-11-14-4-2-10-20-18(14)16-9-8-13-7-6-12-3-1-5-15(16)17(12)13;1-12-4-3-11-19-18(12)16-10-9-14-8-7-13-5-2-6-15(16)17(13)14;1-12-8-9-16(15-7-3-2-6-14(12)15)17-13(11-18)5-4-10-19-17;1-2-6-14(7-3-1)10-12-16-13-11-15-8-4-5-9-17(15)18-16;17-11-13-7-4-10-18-16(13)15-9-3-6-12-5-1-2-8-14(12)15;1-12-6-5-11-17-16(12)15-10-4-8-13-7-2-3-9-14(13)15;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;1-8-6-11(14-15-12(8)13)9-4-3-5-10(7-9)16-2;1-2-6-10(7-3-1)11-8-4-5-9-12-11;7*1-4(6)3-5(2)7;;;;;;;;;;/h4-13,15H,1-3H3;3-13,15H,1-2H3;4-9,11-15H,1-3H3;1-12,14-15H;1-5,8,10H,6-7H2;2-6,9,11H,7-8H2,1H3;2-8,10H,1H3;1-9,11-13H;1-8,10H;2-9,11H,1H3;1-6,8-11H;3,5-7H,1-2H3;1-6,8-9H;7*3,6H,1-2H3;;;;;;;;;;/q13*-1;;;;;;;;;;;;;;;;;
InChIKeyOAEMWSJUNKRMIO-UHFFFAOYSA-N
XLogP62.47
TPSA539.23 Ų
H-Bond Donors7
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms309
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005861.44
LogP ≤ 562.47
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1033

Analyze [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline?
The IUPAC name of [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline (CID 159059184) is [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline.
What is the SMILES notation for [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline?
The canonical SMILES for [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline is CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(=O)C=C(C)O.CC(C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.COc1cc[c-]c(-c2cc(C)c(Cl)nn2)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1.Cc1[c-]c(-c2ccc3cc(-c4ccccc4)ccc3n2)cc(C)c1C.Cc1c[c-]c(-c2ncccc2C#N)c2ccccc12.Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.Cc1cccnc1-c1[c-]ccc2ccccc12.N#Cc1cccnc1-c1[c-]cc2c3c(cccc13)CC2.N#Cc1cccnc1-c1[c-]ccc2ccccc12.[C-](=C/c1ccc2ccccc2n1)\c1ccccc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccc2ccccc2c1-c1ncccc1-c1ccccc1.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline?
The InChIKey is OAEMWSJUNKRMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N.C23H18N.C22H20NO.C21H14N.C18H11N2.C18H14N.C17H11N2.C17H12N.C16H9N2.C16H12N.C15H10N.C12H10ClN2O.C11H8N.7C5H8O2.10Ir/c1-16-13-22(14-17(2)18(16)3)24-12-10-21-15-20(9-11-23(21)25-24)19-7-5-4-6-8-19;1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18;1-22(2,3)19-12-9-16(10-13-19)20-14-11-18(15-23-20)21(24)17-7-5-4-6-8-17;1-2-8-17(9-3-1)19-14-7-15-22-21(19)20-13-6-11-16-10-4-5-12-18(16)20;19-11-14-4-2-10-20-18(14)16-9-8-13-7-6-12-3-1-5-15(16)17(12)13;1-12-4-3-11-19-18(12)16-10-9-14-8-7-13-5-2-6-15(16)17(13)14;1-12-8-9-16(15-7-3-2-6-14(12)15)17-13(11-18)5-4-10-19-17;1-2-6-14(7-3-1)10-12-16-13-11-15-8-4-5-9-17(15)18-16;17-11-13-7-4-10-18-16(13)15-9-3-6-12-5-1-2-8-14(12)15;1-12-6-5-11-17-16(12)15-10-4-8-13-7-2-3-9-14(13)15;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;1-8-6-11(14-15-12(8)13)9-4-3-5-10(7-9)16-2;1-2-6-10(7-3-1)11-8-4-5-9-12-11;7*1-4(6)3-5(2)7;;;;;;;;;;/h4-13,15H,1-3H3;3-13,15H,1-2H3;4-9,11-15H,1-3H3;1-12,14-15H;1-5,8,10H,6-7H2;2-6,9,11H,7-8H2,1H3;2-8,10H,1H3;1-9,11-13H;1-8,10H;2-9,11H,1H3;1-6,8-11H;3,5-7H,1-2H3;1-6,8-9H;7*3,6H,1-2H3;;;;;;;;;;/q13*-1;;;;;;;;;;;;;;;;;.
What are the key properties of [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline?
[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline has a molecular weight of 5861.44 g/mol, XLogP of 62.47, 27 rotatable bonds, 7 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-phenylmethanone;3-chloro-6-(3-methoxybenzene-6-id-1-yl)-4-methylpyridazine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)-3-methylpyridine;2-(2,4-dihydro-1H-acenaphthylen-4-id-5-yl)pyridine-3-carbonitrile;2-(3,5-dimethylbenzene-6-id-1-yl)-6-phenylquinoline;heptakis(4-hydroxypent-3-en-2-one);decakis(iridium);3-methyl-2-(2H-naphthalen-2-id-1-yl)pyridine;2-(4-methyl-2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2H-naphthalen-2-id-1-yl)-3-phenylpyridine;2-(2H-naphthalen-2-id-1-yl)pyridine-3-carbonitrile;2-(2-phenylethenyl)quinoline;2-phenylpyridine;2-phenylquinoline;6-phenyl-2-(3,4,5-trimethylbenzene-6-id-1-yl)quinoline is sourced from PubChem (CID 159059184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).