1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane

C240H270F4N12O2SSi2 — CID 162023588

IUPAC1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
SMILESCC(C)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.CC(C)c1ccc(-n2c3ccccc3c3ccccc32)cc1.CC(C)c1ccc(C#N)cc1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc([Si](C)(C)C)cc1.CC(C)c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.CC(C)c1ccc2c(c1)c1ccccc1n2-c1ccccc1.CC(C)c1ccc2c(ccc3ccccc32)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1nc2ccccc2n1-c1ccccc1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1ncccn1.COc1ccc(C(C)C)cc1
InChIInChI=1S/C27H26Si.2C21H19N.C21H20.C17H16.C16H16N2.C15H22.C12H20Si.C10H11F3.C10H11NO.C10H11NS.C10H11N.C10H14O.C9H11F.3C8H11N.C7H10N2/c1-22(2)23-18-20-27(21-19-23)28(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26;1-15(2)16-11-13-17(14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22;1-15(2)16-12-13-21-19(14-16)18-10-6-7-11-20(18)22(21)17-8-4-3-5-9-17;1-16(2)17-8-10-20(11-9-17)21-14-12-19(13-15-21)18-6-4-3-5-7-18;1-12(2)14-9-10-17-15(11-14)8-7-13-5-3-4-6-16(13)17;1-12(2)16-17-14-10-6-7-11-15(14)18(16)13-8-4-3-5-9-13;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-7(2)8-3-5-9(6-4-8)10(11,12)13;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-8(2)10-5-3-9(7-11)4-6-10;1-8(2)9-4-6-10(11-3)7-5-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-8-4-3-5-9-7/h3-22H,1-2H3;2*3-15H,1-2H3;3-16H,1-2H3;3-12H,1-2H3;3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-10H,1-5H3;3-7H,1-2H3;2*3-7H,1-2H3;3-6,8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3
InChIKeyYVBLKOJURNADNI-UHFFFAOYSA-N
MW3519.11 g/mol
LogP66.49
Rot. Bonds30

About 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane

1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane (PubChem CID 162023588) has the molecular formula C240H270F4N12O2SSi2 and a molecular weight of 3519.11 g/mol. Its IUPAC name is 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane.

Molecular Properties

Compound Name1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
PubChem CID162023588
Molecular FormulaC240H270F4N12O2SSi2
Molecular Weight3519.11 g/mol
Exact Mass3516.06
IUPAC Name1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
SMILESCC(C)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.CC(C)c1ccc(-n2c3ccccc3c3ccccc32)cc1.CC(C)c1ccc(C#N)cc1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc([Si](C)(C)C)cc1.CC(C)c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.CC(C)c1ccc2c(c1)c1ccccc1n2-c1ccccc1.CC(C)c1ccc2c(ccc3ccccc32)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1nc2ccccc2n1-c1ccccc1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1ncccn1.COc1ccc(C(C)C)cc1
InChIInChI=1S/C27H26Si.2C21H19N.C21H20.C17H16.C16H16N2.C15H22.C12H20Si.C10H11F3.C10H11NO.C10H11NS.C10H11N.C10H14O.C9H11F.3C8H11N.C7H10N2/c1-22(2)23-18-20-27(21-19-23)28(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26;1-15(2)16-11-13-17(14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22;1-15(2)16-12-13-21-19(14-16)18-10-6-7-11-20(18)22(21)17-8-4-3-5-9-17;1-16(2)17-8-10-20(11-9-17)21-14-12-19(13-15-21)18-6-4-3-5-7-18;1-12(2)14-9-10-17-15(11-14)8-7-13-5-3-4-6-16(13)17;1-12(2)16-17-14-10-6-7-11-15(14)18(16)13-8-4-3-5-9-13;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-7(2)8-3-5-9(6-4-8)10(11,12)13;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-8(2)10-5-3-9(7-11)4-6-10;1-8(2)9-4-6-10(11-3)7-5-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-8-4-3-5-9-7/h3-22H,1-2H3;2*3-15H,1-2H3;3-16H,1-2H3;3-12H,1-2H3;3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-10H,1-5H3;3-7H,1-2H3;2*3-7H,1-2H3;3-6,8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3
InChIKeyYVBLKOJURNADNI-UHFFFAOYSA-N
XLogP66.49
TPSA164.07 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds30
Heavy Atoms261
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003519.11
LogP ≤ 566.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane with MolForge

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Related Compounds

1-Cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;9-phenyl-4-propan-2-ylcarbazole;1-phenyl-2-(4-propan-2-ylphenyl)benzimidazole;4-propan-2-ylbenzonitrile;5-propan-2-yl-1,2-dihydroacenaphthylene;1-propan-2-ylisoquinoline;2-(4-propan-2-ylphenyl)-1,3-benzothiazole;2-(4-propan-2-ylphenyl)-1,3-benzoxazole;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylquinoline;5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane
CID 157063515
1-cyclohexyl-3-propan-2-ylbenzene;1-cyclopentyl-3-propan-2-ylbenzene;2-methyl-4-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;1-(2-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 157464689
2-[3-(10b,10c-Dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;2-[3-(10b,10c-dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole-6-carbonitrile;5-[6-(1-phenylbenzimidazol-2-yl)-2-pyridin-3-ylpyrimidin-4-yl]-1,10-phenanthroline;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-6-(trifluoromethyl)-1,3-benzoxazole
CID 157769145
6-fluoro-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1,3-benzothiazol-2-amine;6-fluoro-N-[2-[4-[(2-propan-2-yloxyphenyl)methyl]piperazin-1-yl]ethyl]-1,3-benzothiazol-2-amine;N-[4-[4-(5-fluoropyrimidin-2-yl)piperazin-1-yl]butyl]-1,3-benzothiazol-2-amine;1-methyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]benzimidazole;N-[2-(4-naphthalen-2-ylpiperazin-1-yl)ethyl]-1,3-benzothiazol-2-amine;N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,3-benzoxazol-2-amine
CID 157832980
2-[3-(10b,10c-Dihydropyren-4-yl)-5-[4-(3,5-diphenyl-1,2,4-triazol-4-yl)phenyl]phenyl]-1,3-benzoxazole;2-[3-benzo[h]quinolin-5-yl-5-[3-[5-(3,5-dimethylphenyl)-4-phenyl-1,2,4-triazol-3-yl]phenyl]phenyl]-1,3-benzothiazole;2-[3-[4-[3-(4-methylphenyl)-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]phenyl]-5-quinolin-5-ylphenyl]-1,3-benzoxazole
CID 157966551
1H-benzimidazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzothiazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-pyrrol-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158306259
benzaldehyde;benzonitrile;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;2-(1,1-difluoroethyl)-1,3-bis(trifluoromethyl)benzene;3H-indole;4-methylidenecyclopent-2-en-1-one;4H-naphthalen-1-one;1,6-naphthyridine;phenanthridine;1H-phenanthro[9,10-d]imidazole;1,10-phenanthroline;2-phenyl-1,3-benzoxazole;2-pyridin-2-ylpyridine;quinoline
CID 158538440
CID 158633368
CID 158633368
1-(1,1-Difluoroethyl)-3-methyl-5-(trifluoromethyl)benzene;2,6-dimethyl-1,3-benzothiazole;2,5-dimethyl-1-benzothiophene;2,6-dimethyl-1,3-benzoxazole;3,7-dimethylimidazo[4,5-f]benzimidazole;2,3-dimethyl-1,10-phenanthroline;10-methylacridin-9-one;4-methylbenzene-1,2-dicarbonitrile;4-methyl-[1]benzothiolo[2,3-b]pyridine;9-methylcarbazole;4-methyldibenzothiophene;6-methyl-2-phenyl-1,3-benzoxazole;1-(4-methylphenyl)ethanone;9-methylpyrido[2,3-b]indole;3-methylquinoline;8-methyl-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;2,2,2-trifluoro-1-(3-methylphenyl)ethanone
CID 158821818
6-[2-(Benzimidazol-1-yl)ethyl]-5-phenylindolo[2,3-b]indole;9-[8-(2-dibenzofuran-2-ylethyl)dibenzofuran-4-yl]carbazole-3-carbonitrile;9,9-dimethyl-10-[2-[3-(2,2,3,3-tetrafluoropropyl)carbazol-9-yl]ethyl]acridine;3-[5-[2-(18,27-diphenyl-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25-dodecaen-9-yl)ethyl]-3-pyridinyl]benzonitrile;2-[2-(5-phenylindolo[2,3-b]carbazol-7-yl)ethyl]-1,3-benzothiazole;9-phenyl-14-[2-(1-phenylbenzimidazol-2-yl)ethyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-phenyl-6-(2-pyrimidin-5-ylethyl)indolo[2,3-b]indole;12-phenyl-5-(pyrimidin-5-yloxymethyl)indolo[3,2-c]carbazole
CID 159195948
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylimidazo[1,2-a]pyridine;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-ylnaphthalene;2-propan-2-ylquinazoline;3-propan-2-ylquinoline;4-propan-2-ylquinoline;2-propan-2-ylquinoxaline;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;3-propan-2-yl-5-(trifluoromethyl)pyridine;4-propan-2-yl-2-(trifluoromethyl)pyridine
CID 159430087
2-tert-butylbenzonitrile;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;1-tert-butylimidazole;2-tert-butyl-3H-indole;3-tert-butylisoquinoline;4-tert-butyl-1-methylpyrazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butylquinazoline;2-tert-butyl-1,3-thiazole;5-tert-butyl-1,3-thiazole;4-tert-butyl-2H-triazole;3-(2,2-dimethylpropyl)-1,1-difluorocyclobutane;4-(2,2-dimethylpropyl)oxane
CID 159544015

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane?
The IUPAC name of 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane (CID 162023588) is 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane.
What is the SMILES notation for 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane?
The canonical SMILES for 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane is CC(C)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.CC(C)c1ccc(-n2c3ccccc3c3ccccc32)cc1.CC(C)c1ccc(C#N)cc1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C2CCCCC2)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc([Si](C)(C)C)cc1.CC(C)c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.CC(C)c1ccc2c(c1)c1ccccc1n2-c1ccccc1.CC(C)c1ccc2c(ccc3ccccc32)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1nc2ccccc2n1-c1ccccc1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1ncccn1.COc1ccc(C(C)C)cc1.
What is the InChIKey of 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane?
The InChIKey is YVBLKOJURNADNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26Si.2C21H19N.C21H20.C17H16.C16H16N2.C15H22.C12H20Si.C10H11F3.C10H11NO.C10H11NS.C10H11N.C10H14O.C9H11F.3C8H11N.C7H10N2/c1-22(2)23-18-20-27(21-19-23)28(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26;1-15(2)16-11-13-17(14-12-16)22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22;1-15(2)16-12-13-21-19(14-16)18-10-6-7-11-20(18)22(21)17-8-4-3-5-9-17;1-16(2)17-8-10-20(11-9-17)21-14-12-19(13-15-21)18-6-4-3-5-7-18;1-12(2)14-9-10-17-15(11-14)8-7-13-5-3-4-6-16(13)17;1-12(2)16-17-14-10-6-7-11-15(14)18(16)13-8-4-3-5-9-13;1-12(2)13-8-10-15(11-9-13)14-6-4-3-5-7-14;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-7(2)8-3-5-9(6-4-8)10(11,12)13;2*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-8(2)10-5-3-9(7-11)4-6-10;1-8(2)9-4-6-10(11-3)7-5-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-6(2)7-8-4-3-5-9-7/h3-22H,1-2H3;2*3-15H,1-2H3;3-16H,1-2H3;3-12H,1-2H3;3-12H,1-2H3;8-12,14H,3-7H2,1-2H3;6-10H,1-5H3;3-7H,1-2H3;2*3-7H,1-2H3;3-6,8H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3*3-7H,1-2H3;3-6H,1-2H3.
What are the key properties of 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane?
1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane has a molecular weight of 3519.11 g/mol, XLogP of 66.49, 30 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-phenyl-2-propan-2-ylbenzimidazole;9-phenyl-3-propan-2-ylcarbazole;1-phenyl-4-(4-propan-2-ylphenyl)benzene;4-propan-2-ylbenzonitrile;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylphenanthrene;9-(4-propan-2-ylphenyl)carbazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;1-propan-2-yl-4-(trifluoromethyl)benzene;trimethyl-(4-propan-2-ylphenyl)silane;triphenyl-(4-propan-2-ylphenyl)silane is sourced from PubChem (CID 162023588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).