6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole

C191H243Cl2F6N22O8+ — CID 159820368

IUPAC6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole
SMILESC=C1N(C2=CCCCC2)c2ccccc2N1C(C)C.CC(C)c1ccc(F)cc1.CC(C)c1ccccn1.CC(C)c1cn(C)c2cc(CN)ccc12.CC(C)n1c(CN2CCOCC2)nc2ccccc21.CC(C)n1c2c(c3ccccc31)C(=O)CCC2.CC(C)n1ccc2cc(Cl)ccc21.CC(C)n1ccc2cc(F)c(Cl)cc21.CC(C)n1ccc2ccc(C(F)(F)F)cc21.CC(C)n1ccc2ccc(O)cc21.COC1CN(C(=O)Cc2c(C)n(C(C)C)c3ccccc23)C1.COC1CN(C(=O)c2cc(C(C)C)[nH][n+]2C(C)C)C1.Cc1cc2c(cc1O)c(C(C)C)cn2C.Cc1cc2cc(F)ccc2n1C(C)C.Cc1cc2cn(C(C)C)nc2cc1C
InChIInChI=1S/C18H24N2O2.C17H22N2.C15H21N3O.C15H17NO.C14H23N3O2.C13H18N2.C13H17NO.C12H12F3N.C12H14FN.C12H16N2.C11H11ClFN.C11H12ClN.C11H13NO.C9H11F.C8H11N/c1-12(2)20-13(3)16(15-7-5-6-8-17(15)20)9-18(21)19-10-14(11-19)22-4;1-13(2)18-14(3)19(15-9-5-4-6-10-15)17-12-8-7-11-16(17)18;1-12(2)18-14-6-4-3-5-13(14)16-15(18)11-17-7-9-19-10-8-17;1-10(2)16-12-7-4-3-6-11(12)15-13(16)8-5-9-14(15)17;1-9(2)12-6-13(17(15-12)10(3)4)14(18)16-7-11(8-16)19-5;1-9(2)12-8-15(3)13-6-10(7-14)4-5-11(12)13;1-8(2)11-7-14(4)12-5-9(3)13(15)6-10(11)12;1-8(2)16-6-5-9-3-4-10(7-11(9)16)12(13,14)15;1-8(2)14-9(3)6-10-7-11(13)4-5-12(10)14;1-8(2)14-7-11-5-9(3)10(4)6-12(11)13-14;1-7(2)14-4-3-8-5-10(13)9(12)6-11(8)14;1-8(2)13-6-5-9-7-10(12)3-4-11(9)13;1-8(2)12-6-5-9-3-4-10(13)7-11(9)12;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8/h5-8,12,14H,9-11H2,1-4H3;7-9,11-13H,3-6,10H2,1-2H3;3-6,12H,7-11H2,1-2H3;3-4,6-7,10H,5,8-9H2,1-2H3;6,9-11H,7-8H2,1-5H3;4-6,8-9H,7,14H2,1-3H3;5-8,15H,1-4H3;3-8H,1-2H3;4-8H,1-3H3;5-8H,1-4H3;3-7H,1-2H3;3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3;3-7H,1-2H3/p+1
InChIKeyQQSHECOMQMXXQT-UHFFFAOYSA-O
MW3160.08 g/mol
LogP48.44
Rot. Bonds25

About 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole

6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole (PubChem CID 159820368) has the molecular formula C191H243Cl2F6N22O8+ and a molecular weight of 3160.08 g/mol. Its IUPAC name is 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole.

Molecular Properties

Compound Name6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole
PubChem CID159820368
Molecular FormulaC191H243Cl2F6N22O8+
Molecular Weight3160.08 g/mol
Exact Mass3156.86
IUPAC Name6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole
SMILESC=C1N(C2=CCCCC2)c2ccccc2N1C(C)C.CC(C)c1ccc(F)cc1.CC(C)c1ccccn1.CC(C)c1cn(C)c2cc(CN)ccc12.CC(C)n1c(CN2CCOCC2)nc2ccccc21.CC(C)n1c2c(c3ccccc31)C(=O)CCC2.CC(C)n1ccc2cc(Cl)ccc21.CC(C)n1ccc2cc(F)c(Cl)cc21.CC(C)n1ccc2ccc(C(F)(F)F)cc21.CC(C)n1ccc2ccc(O)cc21.COC1CN(C(=O)Cc2c(C)n(C(C)C)c3ccccc23)C1.COC1CN(C(=O)c2cc(C(C)C)[nH][n+]2C(C)C)C1.Cc1cc2c(cc1O)c(C(C)C)cn2C.Cc1cc2cc(F)ccc2n1C(C)C.Cc1cc2cn(C(C)C)nc2cc1C
InChIInChI=1S/C18H24N2O2.C17H22N2.C15H21N3O.C15H17NO.C14H23N3O2.C13H18N2.C13H17NO.C12H12F3N.C12H14FN.C12H16N2.C11H11ClFN.C11H12ClN.C11H13NO.C9H11F.C8H11N/c1-12(2)20-13(3)16(15-7-5-6-8-17(15)20)9-18(21)19-10-14(11-19)22-4;1-13(2)18-14(3)19(15-9-5-4-6-10-15)17-12-8-7-11-16(17)18;1-12(2)18-14-6-4-3-5-13(14)16-15(18)11-17-7-9-19-10-8-17;1-10(2)16-12-7-4-3-6-11(12)15-13(16)8-5-9-14(15)17;1-9(2)12-6-13(17(15-12)10(3)4)14(18)16-7-11(8-16)19-5;1-9(2)12-8-15(3)13-6-10(7-14)4-5-11(12)13;1-8(2)11-7-14(4)12-5-9(3)13(15)6-10(11)12;1-8(2)16-6-5-9-3-4-10(7-11(9)16)12(13,14)15;1-8(2)14-9(3)6-10-7-11(13)4-5-12(10)14;1-8(2)14-7-11-5-9(3)10(4)6-12(11)13-14;1-7(2)14-4-3-8-5-10(13)9(12)6-11(8)14;1-8(2)13-6-5-9-7-10(12)3-4-11(9)13;1-8(2)12-6-5-9-3-4-10(13)7-11(9)12;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8/h5-8,12,14H,9-11H2,1-4H3;7-9,11-13H,3-6,10H2,1-2H3;3-6,12H,7-11H2,1-2H3;3-4,6-7,10H,5,8-9H2,1-2H3;6,9-11H,7-8H2,1-5H3;4-6,8-9H,7,14H2,1-3H3;5-8,15H,1-4H3;3-8H,1-2H3;4-8H,1-3H3;5-8H,1-4H3;3-7H,1-2H3;3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3;3-7H,1-2H3/p+1
InChIKeyQQSHECOMQMXXQT-UHFFFAOYSA-O
XLogP48.44
TPSA274.15 Ų
H-Bond Donors4
H-Bond Acceptors26
Rotatable Bonds25
Heavy Atoms229
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003160.08
LogP ≤ 548.44
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole with MolForge

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Related Compounds

5-chloro-1-propan-2-ylindole;2-(1,1-difluoroethyl)-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;5,6-dimethyl-2-propan-2-ylindazole;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;methane;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;1-methoxy-3-propan-2-ylbenzene;6-methyl-3-propan-2-yl-1H-indol-5-ol;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-methyl-3-propan-2-yl-5-(trifluoromethyl)indole;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;1-propan-2-ylindazol-6-ol;1-propan-2-yl-6-(trifluoromethyl)indole
CID 157577967
5-chloro-1-propan-2-ylindole;2-(1,1-difluoroethyl)-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-yl-3H-indol-1-ium-5-ol;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;1-methoxy-3-propan-2-ylbenzene;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-methyl-3-propan-2-yl-5-(trifluoromethyl)indole;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;1-propan-2-ylindazol-6-ol;1-propan-2-yl-6-(trifluoromethyl)indole
CID 157662877
5,6-difluoro-1-propan-2-ylindole;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;5-fluoro-1-propan-2-ylindole;1-methoxy-3-propan-2-ylbenzene;6-methyl-3-propan-2-yl-1H-indol-5-ol;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-propan-2-ylindazol-6-ol;1-propan-2-yl-2-(trifluoromethyl)indole;1-propan-2-yl-6-(trifluoromethyl)indole;3-propan-2-yl-5-(trifluoromethyl)-1H-indole
CID 158016030
6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;[1,5-di(propan-2-yl)pyrazol-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;9-propan-2-yl-1,2,3,4-tetrahydrocarbazole;1-propan-2-yl-4-(trifluoromethyl)pyrazole
CID 158439513
3-[2-[(1S)-1-[[2-[6-(aminomethyl)-1H-indol-3-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-N-methylbenzamide;5-[2-[(1S)-1-[[2-(5-chloroindol-1-yl)acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[2-(5,6-dimethylbenzimidazol-1-yl)butanoylamino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[2-(6-hydroxyindazol-1-yl)acetyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 158466458
5-chloro-1-propan-2-ylindole;5,6-difluoro-1-propan-2-ylindole;[1,3-di(propan-2-yl)pyrazol-5-yl]-(3-methoxyazetidin-1-yl)methanone;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;6-methyl-3-propan-2-yl-1H-indol-5-ol;2-methyl-4-propan-2-yl-[1,2,4]triazolo[1,5-a]benzimidazole;1-propan-2-ylindazol-6-ol;1-propan-2-yl-2-(trifluoromethyl)indole;1-propan-2-yl-6-(trifluoromethyl)indole;3-propan-2-yl-5-(trifluoromethyl)-1H-indole
CID 159592086
6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;4-cyclopropyl-5-(difluoromethyl)-3-(1-fluoroethyl)-1-propan-2-ylpyrazole;9-(1,1-difluoroethyl)-7-propan-2-yl-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-5-one;5,6-dimethyl-2-propan-2-ylindazole;[1,5-di(propan-2-yl)pyrazol-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindazol-6-ol;3-propan-2-yl-1H-indol-5-amine;(3-propan-2-yl-1H-indol-6-yl)methanamine;2-propan-2-ylpyridine;9-propan-2-yl-1,2,3,4-tetrahydrocarbazole;1-propan-2-yl-4-(trifluoromethyl)pyrazole
CID 160756518
5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;6-methoxy-N-(3-phenyloxetan-3-yl)-1H-indene-2-carboxamide;2-(3-phenyloxetan-3-yl)-1-[5-(trifluoromethyl)-1H-indol-2-yl]ethanone
CID 160904928
(4R)-4-[3-[3-(1-aminoethenyl)-4-fluorophenyl]-2-pyridinyl]-5-(3,5-difluorophenyl)-1-(5,6-dimethylindazol-2-yl)pentan-2-one;3-[2-[(1S)-1-[[2-[6-(aminomethyl)-1H-indol-3-yl]acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-N-methylbenzamide;5-[2-[(1S)-1-[[2-(5-chloroindol-1-yl)acetyl]amino]-2-(3,5-difluorophenyl)ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[2-(5,6-dimethylbenzimidazol-1-yl)butanoylamino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide;5-[2-[(1S)-2-(3,5-difluorophenyl)-1-[[2-(6-hydroxyindazol-1-yl)acetyl]amino]ethyl]-3-pyridinyl]-2-fluoro-N-methylbenzamide
CID 159845869
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-dimethylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4,6-trichlorobenzamide;2,6-difluoro-N-[5-[5-hydroxy-4-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[5-hydroxy-4-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-yl]benzamide
CID 161218990
N-[3-acetyl-1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclopropylamino]-2-oxoethyl]indol-5-yl]-3-aminobenzamide;5-amino-1-[2-[[2-[[(1S)-1-(3-chloro-2-fluorophenyl)-2-hydroxyethyl]amino]-2-oxoethyl]-cyclopropylamino]-2-oxoethyl]indazole-3-carboxamide;5-amino-1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclopropylamino]-2-oxoethyl]pyrazolo[5,4-b]pyridine-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclopropylamino]-2-oxoethyl]-5-[(2-cyclopropylacetyl)amino]indazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-cyclopropylamino]-2-oxoethyl]-6-hydroxyindazole-3-carboxamide;1-[2-[[2-[(3-chloro-2-fluorophenyl)methylamino]-2-oxoethyl]-propan-2-ylamino]-2-oxoethyl]-5-(piperidine-1-carbonyl)indazole-3-carboxamide
CID 161402512
CID 165056091
CID 165056091

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole?
The IUPAC name of 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole (CID 159820368) is 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole.
What is the SMILES notation for 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole?
The canonical SMILES for 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole is C=C1N(C2=CCCCC2)c2ccccc2N1C(C)C.CC(C)c1ccc(F)cc1.CC(C)c1ccccn1.CC(C)c1cn(C)c2cc(CN)ccc12.CC(C)n1c(CN2CCOCC2)nc2ccccc21.CC(C)n1c2c(c3ccccc31)C(=O)CCC2.CC(C)n1ccc2cc(Cl)ccc21.CC(C)n1ccc2cc(F)c(Cl)cc21.CC(C)n1ccc2ccc(C(F)(F)F)cc21.CC(C)n1ccc2ccc(O)cc21.COC1CN(C(=O)Cc2c(C)n(C(C)C)c3ccccc23)C1.COC1CN(C(=O)c2cc(C(C)C)[nH][n+]2C(C)C)C1.Cc1cc2c(cc1O)c(C(C)C)cn2C.Cc1cc2cc(F)ccc2n1C(C)C.Cc1cc2cn(C(C)C)nc2cc1C.
What is the InChIKey of 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole?
The InChIKey is QQSHECOMQMXXQT-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H24N2O2.C17H22N2.C15H21N3O.C15H17NO.C14H23N3O2.C13H18N2.C13H17NO.C12H12F3N.C12H14FN.C12H16N2.C11H11ClFN.C11H12ClN.C11H13NO.C9H11F.C8H11N/c1-12(2)20-13(3)16(15-7-5-6-8-17(15)20)9-18(21)19-10-14(11-19)22-4;1-13(2)18-14(3)19(15-9-5-4-6-10-15)17-12-8-7-11-16(17)18;1-12(2)18-14-6-4-3-5-13(14)16-15(18)11-17-7-9-19-10-8-17;1-10(2)16-12-7-4-3-6-11(12)15-13(16)8-5-9-14(15)17;1-9(2)12-6-13(17(15-12)10(3)4)14(18)16-7-11(8-16)19-5;1-9(2)12-8-15(3)13-6-10(7-14)4-5-11(12)13;1-8(2)11-7-14(4)12-5-9(3)13(15)6-10(11)12;1-8(2)16-6-5-9-3-4-10(7-11(9)16)12(13,14)15;1-8(2)14-9(3)6-10-7-11(13)4-5-12(10)14;1-8(2)14-7-11-5-9(3)10(4)6-12(11)13-14;1-7(2)14-4-3-8-5-10(13)9(12)6-11(8)14;1-8(2)13-6-5-9-7-10(12)3-4-11(9)13;1-8(2)12-6-5-9-3-4-10(13)7-11(9)12;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9-8/h5-8,12,14H,9-11H2,1-4H3;7-9,11-13H,3-6,10H2,1-2H3;3-6,12H,7-11H2,1-2H3;3-4,6-7,10H,5,8-9H2,1-2H3;6,9-11H,7-8H2,1-5H3;4-6,8-9H,7,14H2,1-3H3;5-8,15H,1-4H3;3-8H,1-2H3;4-8H,1-3H3;5-8H,1-4H3;3-7H,1-2H3;3-8H,1-2H3;3-8,13H,1-2H3;3-7H,1-2H3;3-7H,1-2H3/p+1.
What are the key properties of 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole?
6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole has a molecular weight of 3160.08 g/mol, XLogP of 48.44, 25 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-fluoro-1-propan-2-ylindole;5-chloro-1-propan-2-ylindole;1-(cyclohexen-1-yl)-2-methylidene-3-propan-2-ylbenzimidazole;5,6-dimethyl-2-propan-2-ylindazole;1,6-dimethyl-3-propan-2-ylindol-5-ol;[2,5-di(propan-2-yl)-1H-pyrazol-2-ium-3-yl]-(3-methoxyazetidin-1-yl)methanone;5-fluoro-2-methyl-1-propan-2-ylindole;1-fluoro-4-propan-2-ylbenzene;1-(3-methoxyazetidin-1-yl)-2-(2-methyl-1-propan-2-ylindol-3-yl)ethanone;(1-methyl-3-propan-2-ylindol-6-yl)methanamine;4-[(1-propan-2-ylbenzimidazol-2-yl)methyl]morpholine;9-propan-2-yl-2,3-dihydro-1H-carbazol-4-one;1-propan-2-ylindol-6-ol;2-propan-2-ylpyridine;1-propan-2-yl-6-(trifluoromethyl)indole is sourced from PubChem (CID 159820368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).