1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline

C257H332N24O6S — CID 157486796

IUPAC1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2ccccc2s1.CC(C)c1ccc(-c2cccnc2)cc1.CC(C)c1ccc(-c2cncn2C)cc1.CC(C)c1ccc(-c2cnn(C)c2)cc1.CC(C)c1ccc(-n2ccnn2)cc1.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)OCC(=O)C2.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccnc2c1.Cc1c(-c2ccc(C(C)C)cc2)cnn1C.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccncc1-c1ccc(C(C)C)cc1.Cc1cncc(-c2ccc(C(C)C)cc2)c1.Cc1noc(-c2ccc(C(C)C)cc2)n1.Cc1noc(-c2ccc(C(C)C)cc2)n1
InChIInChI=1S/2C15H17N.C14H18N2.C14H15N.2C14H16.2C13H16N2.2C13H15N.2C12H14N2O.C12H14O2.C11H13N3.C11H12N2.2C11H13NO.C11H12S.C10H12N2.9C2H6/c1-11(2)13-4-6-14(7-5-13)15-8-12(3)9-16-10-15;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3;1-10(2)12-5-7-13(8-6-12)14-9-15-16(4)11(14)3;1-11(2)12-5-7-13(8-6-12)14-4-3-9-15-10-14;2*1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-10(2)11-4-6-12(7-5-11)13-8-14-9-15(13)3;1-10(2)11-4-6-12(7-5-11)13-8-14-15(3)9-13;2*1-9(2)11-6-7-13-12(8-11)5-4-10(3)14-13;2*1-8(2)10-4-6-11(7-5-10)12-13-9(3)14-15-12;1-8(2)9-3-4-10-5-11(13)7-14-12(10)6-9;1-9(2)10-3-5-11(6-4-10)14-8-7-12-13-14;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;2*1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-3-4-10-11-5-6-12(10)7-9;9*1-2/h2*4-11H,1-3H3;5-10H,1-4H3;3-11H,1-2H3;2*4-10H,1-3H3;2*4-10H,1-3H3;2*4-9H,1-3H3;2*4-8H,1-3H3;3-4,6,8H,5,7H2,1-2H3;3-9H,1-2H3;3-8H,1-2H3;2*3-5,7H,6H2,1-2H3,(H,12,13);2*3-8H,1-2H3;9*1-2H3
InChIKeyBWUSPDJBWQDKNC-UHFFFAOYSA-N
MW3885.71 g/mol
LogP72.17
Rot. Bonds28

About 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline

1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline (PubChem CID 157486796) has the molecular formula C257H332N24O6S and a molecular weight of 3885.71 g/mol. Its IUPAC name is 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline.

Molecular Properties

Compound Name1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline
PubChem CID157486796
Molecular FormulaC257H332N24O6S
Molecular Weight3885.71 g/mol
Exact Mass3882.61
IUPAC Name1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2ccccc2s1.CC(C)c1ccc(-c2cccnc2)cc1.CC(C)c1ccc(-c2cncn2C)cc1.CC(C)c1ccc(-c2cnn(C)c2)cc1.CC(C)c1ccc(-n2ccnn2)cc1.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)OCC(=O)C2.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccnc2c1.Cc1c(-c2ccc(C(C)C)cc2)cnn1C.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccncc1-c1ccc(C(C)C)cc1.Cc1cncc(-c2ccc(C(C)C)cc2)c1.Cc1noc(-c2ccc(C(C)C)cc2)n1.Cc1noc(-c2ccc(C(C)C)cc2)n1
InChIInChI=1S/2C15H17N.C14H18N2.C14H15N.2C14H16.2C13H16N2.2C13H15N.2C12H14N2O.C12H14O2.C11H13N3.C11H12N2.2C11H13NO.C11H12S.C10H12N2.9C2H6/c1-11(2)13-4-6-14(7-5-13)15-8-12(3)9-16-10-15;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3;1-10(2)12-5-7-13(8-6-12)14-9-15-16(4)11(14)3;1-11(2)12-5-7-13(8-6-12)14-4-3-9-15-10-14;2*1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-10(2)11-4-6-12(7-5-11)13-8-14-9-15(13)3;1-10(2)11-4-6-12(7-5-11)13-8-14-15(3)9-13;2*1-9(2)11-6-7-13-12(8-11)5-4-10(3)14-13;2*1-8(2)10-4-6-11(7-5-10)12-13-9(3)14-15-12;1-8(2)9-3-4-10-5-11(13)7-14-12(10)6-9;1-9(2)10-3-5-11(6-4-10)14-8-7-12-13-14;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;2*1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-3-4-10-11-5-6-12(10)7-9;9*1-2/h2*4-11H,1-3H3;5-10H,1-4H3;3-11H,1-2H3;2*4-10H,1-3H3;2*4-10H,1-3H3;2*4-9H,1-3H3;2*4-8H,1-3H3;3-4,6,8H,5,7H2,1-2H3;3-9H,1-2H3;3-8H,1-2H3;2*3-5,7H,6H2,1-2H3,(H,12,13);2*3-8H,1-2H3;9*1-2H3
InChIKeyBWUSPDJBWQDKNC-UHFFFAOYSA-N
XLogP72.17
TPSA354.04 Ų
H-Bond Donors2
H-Bond Acceptors29
Rotatable Bonds28
Heavy Atoms288
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003885.71
LogP ≤ 572.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1029

Analyze 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline with MolForge

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Related Compounds

3-tert-butyl-1-benzothiophene;5-tert-butyl-2-[6-(dimethylamino)-3-pyridinyl]-1,4-dihydroisoquinolin-3-one;4-tert-butyl-5-fluoro-1H-indole;8-tert-butylisoquinoline;5-tert-butyl-2H-isoquinolin-1-one;4-tert-butyl-2-(4-methoxyphenyl)-3H-isoindol-1-one;1-tert-butyl-6-(1-methylpyrazol-4-yl)indole;4-tert-butyl-2-(1-methylpyrazol-4-yl)-3H-isoindol-1-one;8-tert-butyl-2-(4-pyrrolidin-1-ylphenyl)imidazo[1,2-a]pyridine;5-tert-butylquinazolin-2-amine;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;3-tert-butyl-5-(trifluoromethyl)-3a,7a-dihydro-1H-pyrrolo[2,3-b]pyridine;8-tert-butyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 159061409
2,2-difluoro-4-propan-2-yl-1,3-benzodioxole;5,7-dimethyl-4-propan-2-yl-2,3-dihydro-1H-indene;2,6-dimethyl-5-propan-2-yl-3,4-dihydroisoquinolin-1-one;6,8-dimethyl-5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;5-methoxy-8-propan-2-yl-1,2,3,4-tetrahydronaphthalene;6-methoxy-5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;2-methyl-3-propan-2-yl-1-benzothiophene;6-methyl-5-propan-2-yl-3,4-dihydro-2H-chromene;6-methyl-5-propan-2-yl-3,4-dihydro-1H-isochromene;6-methyl-5-propan-2-yl-3,4-dihydro-2H-isoquinolin-1-one;6-methyl-5-propan-2-ylquinazoline;6-methyl-5-propan-2-yl-1,2,3,4-tetrahydronaphthalene;4-propan-2-yl-2,1,3-benzoxadiazole;5-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-3,4-dihydro-1H-isochromene;4-propan-2-ylpyrazolo[1,5-a]pyridine
CID 161253881
2-(1,1-difluoroethyl)-1-fluoro-3-propan-2-ylbenzene;2,4-dimethyl-1-propan-2-ylbenzene;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;6-fluoro-8-propan-2-yl-3,4-dihydro-2H-chromene;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;5-phenyl-2-propan-2-ylpyridine;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;5-propan-2-ylindolizine;1-propan-2-ylnaphthalene;2-propan-2-yl-1,6-naphthyridine;2-propan-2-yl-1,8-naphthyridine;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 161746974
1-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[4-methyl-3-[(9-methyl-2-pyridin-4-ylpurin-6-yl)amino]phenyl]-2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;N-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethoxy)benzamide;N-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(9-methyl-2-thiophen-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
CID 161981800
2-(5-tert-butyl-2-methylbenzimidazol-1-yl)-N,N-dimethylethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzofuran-3-yl)ethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzothiophen-3-yl)ethanamine;N,N-dimethyl-1-(7-propan-2-yl-1,3-dihydro-2-benzothiophen-4-yl)piperidin-4-amine;N,N-dimethyl-1-(4-propan-2-yl-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-7-yl)piperidin-4-amine;N,N-dimethyl-2-(5-propan-2-ylimidazo[4,5-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylindol-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylpyrrolo[3,2-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-[5-propan-2-yl-2-(trifluoromethyl)benzimidazol-1-yl]ethanamine
CID 167592122
2,6-dimethyl-1H-benzimidazole;2,6-dimethyl-1-benzofuran;2,6-dimethyl-1-benzothiophene;4,6-dimethylpteridine;bis(2,6-dimethylpyridine);2,5-dimethylthiophene;methane;1,2,6-trimethylbenzimidazole;1,2,6-trimethylindole;bis(1,3-xylene)
CID 157052667
1,3-Ditert-butylbenzene;2,5-ditert-butyl-1-benzofuran;2,6-ditert-butyl-1-benzofuran;1,4-ditert-butyl-2,5-dimethylbenzene;3,6-ditert-butyl-2,4-dimethylpyridine;2,5-ditert-butyl-1-methylimidazole;2,4-ditert-butyl-1-methylindole;2,6-ditert-butyl-1-methylindole;3,5-ditert-butyl-1-methylpyrazole;3,6-ditert-butyl-4-methylpyridazine;2,5-ditert-butyl-1-methylpyrrole;2,5-ditert-butylpyrazine;2,4-ditert-butylpyridine;2,6-ditert-butylpyridine;3,5-ditert-butylpyridine;2,5-ditert-butyl-1,3-thiazole;2,5-ditert-butylthiophene;2,5-ditert-butyl-1,3,7-trimethylindole
CID 157077113
7-[9-(4-Dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-4-yl]-4-phenylquinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]quinazoline
CID 157094150
7-[9-(4-Dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]quinoline;6-[9-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]benzimidazolo[1,2-c]quinazoline;2-[4-[9-(2,6-diphenylpyrimidin-4-yl)dibenzofuran-3-yl]phenyl]-1-phenylbenzimidazole;2-[9-(2,6-diphenylpyrimidin-4-yl)dibenzothiophen-3-yl]-1,10-phenanthroline;6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]benzimidazolo[1,2-c]quinazoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]benzo[h]quinoline;2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]-1,10-phenanthroline;2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-3-yl]-4-phenylquinoline;4-phenyl-2-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]quinazoline
CID 157098124
3,9-Dimethyl-2-(1,2,5-trimethyl-1,2,4-triazol-2-ium-3-yl)carbazole;ethane;1,2,4,5,6,7,11-heptamethylphenanthro[9,10-d]triazol-1-ium;5-methyl-4-(1,2,5-trimethyl-1,2,4-triazol-2-ium-3-yl)pyrimidine;1,2,3-trimethyl-5-(2-methyldibenzofuran-3-yl)-1,2,4-triazol-1-ium;1,2,3-trimethyl-5-(2-methyldibenzothiophen-3-yl)-1,2,4-triazol-1-ium
CID 157143661
5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;5-methyl-2,3-dihydroisoindol-1-one;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;6-methyl-3H-imidazo[4,5-c]pyridine;5-methyl-1H-indazole;6-methyl-1H-indazole;5-methyl-1H-indole;6-methyl-1H-indole;5-methyl-3H-isoindol-1-amine;5-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;6-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-c]pyridine;6-methyl-1H-pyrazolo[4,5-c]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;5-methyl-1H-pyrrolo[2,3-c]pyridine;6-methyl-1H-pyrrolo[3,2-c]pyridine;2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157153973
cumene;N,N-dimethyl-4-propan-2-ylaniline;2-fluoro-4-propan-2-ylpyridine;1-methoxy-4-propan-2-ylbenzene;1-methyl-5-propan-2-ylindole;1-methyl-4-propan-2-ylpyrazole;3-propan-2-ylaniline;4-propan-2-ylaniline;2-propan-2-yl-1-benzofuran;5-propan-2-yl-1-benzofuran;2-propan-2-yl-1-benzothiophene;3-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1-benzofuran;3-propan-2-ylfuran;2-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;4-propan-2-ylpyridazine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;6-propan-2-ylquinoline;2-propan-2-ylthiophene;3-propan-2-ylthiophene
CID 157160801

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline?
The IUPAC name of 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline (CID 157486796) is 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline.
What is the SMILES notation for 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline?
The canonical SMILES for 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2ccccc2s1.CC(C)c1ccc(-c2cccnc2)cc1.CC(C)c1ccc(-c2cncn2C)cc1.CC(C)c1ccc(-c2cnn(C)c2)cc1.CC(C)c1ccc(-n2ccnn2)cc1.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2c(c1)OCC(=O)C2.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccnc2c1.Cc1c(-c2ccc(C(C)C)cc2)cnn1C.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2c1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccc2cc(C(C)C)ccc2n1.Cc1ccncc1-c1ccc(C(C)C)cc1.Cc1cncc(-c2ccc(C(C)C)cc2)c1.Cc1noc(-c2ccc(C(C)C)cc2)n1.Cc1noc(-c2ccc(C(C)C)cc2)n1.
What is the InChIKey of 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline?
The InChIKey is BWUSPDJBWQDKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H17N.C14H18N2.C14H15N.2C14H16.2C13H16N2.2C13H15N.2C12H14N2O.C12H14O2.C11H13N3.C11H12N2.2C11H13NO.C11H12S.C10H12N2.9C2H6/c1-11(2)13-4-6-14(7-5-13)15-8-12(3)9-16-10-15;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3;1-10(2)12-5-7-13(8-6-12)14-9-15-16(4)11(14)3;1-11(2)12-5-7-13(8-6-12)14-4-3-9-15-10-14;2*1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-10(2)11-4-6-12(7-5-11)13-8-14-9-15(13)3;1-10(2)11-4-6-12(7-5-11)13-8-14-15(3)9-13;2*1-9(2)11-6-7-13-12(8-11)5-4-10(3)14-13;2*1-8(2)10-4-6-11(7-5-10)12-13-9(3)14-15-12;1-8(2)9-3-4-10-5-11(13)7-14-12(10)6-9;1-9(2)10-3-5-11(6-4-10)14-8-7-12-13-14;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;2*1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-3-4-10-11-5-6-12(10)7-9;9*1-2/h2*4-11H,1-3H3;5-10H,1-4H3;3-11H,1-2H3;2*4-10H,1-3H3;2*4-10H,1-3H3;2*4-9H,1-3H3;2*4-8H,1-3H3;3-4,6,8H,5,7H2,1-2H3;3-9H,1-2H3;3-8H,1-2H3;2*3-5,7H,6H2,1-2H3,(H,12,13);2*3-8H,1-2H3;9*1-2H3.
What are the key properties of 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline?
1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline has a molecular weight of 3885.71 g/mol, XLogP of 72.17, 28 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;ethane;bis(2-methyl-6-propan-2-ylnaphthalene);1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(2-methyl-6-propan-2-ylquinoline);2-propan-2-yl-1-benzothiophene;7-propan-2-yl-4H-chromen-3-one;bis(6-propan-2-yl-1,3-dihydroindol-2-one);6-propan-2-ylimidazo[1,2-a]pyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;6-propan-2-ylquinoxaline is sourced from PubChem (CID 157486796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).