2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole

C222H274Cl2F9N23O13S3 — CID 157269778

IUPAC2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
SMILESCC(C)c1c(Cl)nc2ccccn12.CC(C)c1cc(F)cc2c1OCOC2.CC(C)c1cc2c(OC(F)F)cccc2[nH]1.CC(C)c1ccc2cccc(F)c2n1.CC(C)c1ccc2cccnc2n1.CC(C)c1cccc(F)c1C(F)(F)F.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2c1CCCN2.CC(C)c1cccc2c1OCO2.CC(C)c1cccc2ccncc12.CC(C)c1cccc2ccnn12.CC(C)c1ccccc1S(N)(=O)=O.COc1cc2c(cc1C(C)C)CCC2.Cc1cc(C)n2c(C(C)C)nnc2n1.Cc1ccc(C(C)C)c(Cl)c1.Cc1ccc(C)c2c(C)c(C(C)C)[nH]c12.Cc1ccc(S(C)(=O)=O)cc1C(C)C.Cc1ccc(S(N)(=O)=O)cc1C(C)C.Cc1nc2cc(F)cc(C(C)C)c2nc1C.Cc1noc(-c2ccccc2C(C)C)n1
InChIInChI=1S/C14H19N.C13H15FN2.C13H18O.C12H13F2NO.C12H12FN.C12H14N2O.C12H17N.C12H13N.C11H13FO2.C11H12N2.C11H16O2S.C10H11ClN2.C10H13Cl.C10H10F4.C10H14N4.2C10H12N2.C10H15NO2S.C10H12O2.C9H13NO2S/c1-8(2)13-11(5)12-9(3)6-7-10(4)14(12)15-13;1-7(2)11-5-10(14)6-12-13(11)16-9(4)8(3)15-12;1-9(2)12-7-10-5-4-6-11(10)8-13(12)14-3;1-7(2)10-6-8-9(15-10)4-3-5-11(8)16-12(13)14;1-8(2)11-7-6-9-4-3-5-10(13)12(9)14-11;1-8(2)10-6-4-5-7-11(10)12-13-9(3)14-15-12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-5-3-4-10-6-7-13-8-12(10)11;1-7(2)10-4-9(12)3-8-5-13-6-14-11(8)10;1-8(2)10-6-5-9-4-3-7-12-11(9)13-10;1-8(2)11-7-10(14(4,12)13)6-5-9(11)3;1-7(2)9-10(11)12-8-5-3-4-6-13(8)9;1-7(2)9-5-4-8(3)6-10(9)11;1-6(2)7-4-3-5-8(11)9(7)10(12,13)14;1-6(2)9-12-13-10-11-7(3)5-8(4)14(9)10;1-8(2)10-5-3-4-9-6-7-11-12(9)10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)10-6-9(14(11,12)13)5-4-8(10)3;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)8-5-3-4-6-9(8)13(10,11)12/h6-8,15H,1-5H3;5-7H,1-4H3;7-9H,4-6H2,1-3H3;3-7,12,15H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3,5,7,9,13H,4,6,8H2,1-2H3;3-9H,1-2H3;3-4,7H,5-6H2,1-2H3;3-8H,1-2H3;5-8H,1-4H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;5-6H,1-4H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4-7H,1-3H3,(H2,11,12,13);3-5,7H,6H2,1-2H3;3-7H,1-2H3,(H2,10,11,12)
InChIKeyAYKCHERIONKGGY-UHFFFAOYSA-N
MW3810.87 g/mol
LogP59.83
Rot. Bonds27

About 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole

2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole (PubChem CID 157269778) has the molecular formula C222H274Cl2F9N23O13S3 and a molecular weight of 3810.87 g/mol. Its IUPAC name is 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole.

Molecular Properties

Compound Name2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
PubChem CID157269778
Molecular FormulaC222H274Cl2F9N23O13S3
Molecular Weight3810.87 g/mol
Exact Mass3806.99
IUPAC Name2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
SMILESCC(C)c1c(Cl)nc2ccccn12.CC(C)c1cc(F)cc2c1OCOC2.CC(C)c1cc2c(OC(F)F)cccc2[nH]1.CC(C)c1ccc2cccc(F)c2n1.CC(C)c1ccc2cccnc2n1.CC(C)c1cccc(F)c1C(F)(F)F.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2c1CCCN2.CC(C)c1cccc2c1OCO2.CC(C)c1cccc2ccncc12.CC(C)c1cccc2ccnn12.CC(C)c1ccccc1S(N)(=O)=O.COc1cc2c(cc1C(C)C)CCC2.Cc1cc(C)n2c(C(C)C)nnc2n1.Cc1ccc(C(C)C)c(Cl)c1.Cc1ccc(C)c2c(C)c(C(C)C)[nH]c12.Cc1ccc(S(C)(=O)=O)cc1C(C)C.Cc1ccc(S(N)(=O)=O)cc1C(C)C.Cc1nc2cc(F)cc(C(C)C)c2nc1C.Cc1noc(-c2ccccc2C(C)C)n1
InChIInChI=1S/C14H19N.C13H15FN2.C13H18O.C12H13F2NO.C12H12FN.C12H14N2O.C12H17N.C12H13N.C11H13FO2.C11H12N2.C11H16O2S.C10H11ClN2.C10H13Cl.C10H10F4.C10H14N4.2C10H12N2.C10H15NO2S.C10H12O2.C9H13NO2S/c1-8(2)13-11(5)12-9(3)6-7-10(4)14(12)15-13;1-7(2)11-5-10(14)6-12-13(11)16-9(4)8(3)15-12;1-9(2)12-7-10-5-4-6-11(10)8-13(12)14-3;1-7(2)10-6-8-9(15-10)4-3-5-11(8)16-12(13)14;1-8(2)11-7-6-9-4-3-5-10(13)12(9)14-11;1-8(2)10-6-4-5-7-11(10)12-13-9(3)14-15-12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-5-3-4-10-6-7-13-8-12(10)11;1-7(2)10-4-9(12)3-8-5-13-6-14-11(8)10;1-8(2)10-6-5-9-4-3-7-12-11(9)13-10;1-8(2)11-7-10(14(4,12)13)6-5-9(11)3;1-7(2)9-10(11)12-8-5-3-4-6-13(8)9;1-7(2)9-5-4-8(3)6-10(9)11;1-6(2)7-4-3-5-8(11)9(7)10(12,13)14;1-6(2)9-12-13-10-11-7(3)5-8(4)14(9)10;1-8(2)10-5-3-4-9-6-7-11-12(9)10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)10-6-9(14(11,12)13)5-4-8(10)3;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)8-5-3-4-6-9(8)13(10,11)12/h6-8,15H,1-5H3;5-7H,1-4H3;7-9H,4-6H2,1-3H3;3-7,12,15H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3,5,7,9,13H,4,6,8H2,1-2H3;3-9H,1-2H3;3-4,7H,5-6H2,1-2H3;3-8H,1-2H3;5-8H,1-4H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;5-6H,1-4H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4-7H,1-3H3,(H2,11,12,13);3-5,7H,6H2,1-2H3;3-7H,1-2H3,(H2,10,11,12)
InChIKeyAYKCHERIONKGGY-UHFFFAOYSA-N
XLogP59.83
TPSA476.07 Ų
H-Bond Donors6
H-Bond Acceptors31
Rotatable Bonds27
Heavy Atoms272
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003810.87
LogP ≤ 559.83
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1031

Analyze 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole with MolForge

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Launch Full Analysis

Related Compounds

1-chloro-2-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;1-cyclopentyloxy-2-propan-2-ylbenzene;3,6-dichloro-2-propan-2-ylpyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;1,2-difluoro-3-methyl-4-propan-2-ylbenzene;1,2-difluoro-4-methyl-5-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;4-ethylsulfonyl-1-fluoro-2-propan-2-ylbenzene;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;5-methyl-7-propan-2-yl-1H-indazole;4-propan-2-yl-1,3-benzodioxole;7-propan-2-yl-1H-indole;7-propan-2-ylpyrazolo[1,5-a]pyridine;(6-propan-2-yl-2-pyridinyl)methanol;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;2-propan-2-yl-6-(trifluoromethyl)pyridine;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 157531987
2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 157804501
2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;2-(1,1-difluoroethyl)-1-fluoro-3-propan-2-ylbenzene;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;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-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;methane;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;1-methylsulfonyl-2-propan-2-ylbenzene;5-phenyl-2-propan-2-ylpyridine;4-propan-2-yl-1H-benzimidazole;5-propan-2-ylindolizine;1-propan-2-ylnaphthalene;2-propan-2-yl-1,8-naphthyridine;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 158007516
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
2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;2,4-dimethyl-1-propan-2-ylbenzene;4-(1-fluoroethoxy)-2-propan-2-yl-1H-indole;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;5-phenyl-2-propan-2-ylpyridine;2-propan-2-yl-1,6-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 157843728
4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;2-chloro-1-propan-2-ylpyrazolo[1,2-a]pyridazin-4-ium;1-cyclopentyloxy-2-propan-2-ylbenzene;2,4-dimethyl-1-propan-2-ylbenzene;4-(1-fluoroethoxy)-2-propan-2-yl-1H-indole;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;5-phenyl-2-propan-2-ylpyridine;4-propan-2-yl-1,3-benzodioxole;7-propan-2-yl-1H-isoindole;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole;2,3,7-trimethyl-5-propan-2-ylquinoxaline
CID 159925661
2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;1-cyclopentyloxy-2-propan-2-ylbenzene;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;2,4-dimethyl-1-propan-2-ylbenzene;4-ethylsulfonyl-1-methyl-2-propan-2-ylbenzene;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;5-methyl-7-propan-2-yl-1H-isoindole;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;4-propan-2-yl-1,3-benzodioxole;5-propan-2-ylindolizine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole;2,3,7-trimethyl-5-propan-2-ylquinoxaline
CID 160051724
2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;1-cyclopentyloxy-2-propan-2-ylbenzene;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;4-ethylsulfonyl-1-fluoro-2-propan-2-ylbenzene;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;5-methyl-7-propan-2-yl-1H-indazole;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;4-propan-2-yl-1,3-benzodioxole;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 161022153
2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;5-methyl-7-propan-2-yl-1H-indazole;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1,3-benzodioxole;8-propan-2-yl-4H-1,4-benzoxazin-3-one;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 162096983
2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-chloro-2-propan-2-yl-1-propan-2-yloxybenzene;1-cyclopentyloxy-2-propan-2-ylbenzene;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;2,4-dimethyl-1-propan-2-ylbenzene;4-ethylsulfonyl-1-fluoro-2-propan-2-ylbenzene;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;5-methyl-7-propan-2-yl-1H-indazole;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;4-propan-2-yl-1,3-benzodioxole;5-propan-2-ylindolizine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole
CID 162251890

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole?
The IUPAC name of 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole (CID 157269778) is 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole.
What is the SMILES notation for 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole?
The canonical SMILES for 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole is CC(C)c1c(Cl)nc2ccccn12.CC(C)c1cc(F)cc2c1OCOC2.CC(C)c1cc2c(OC(F)F)cccc2[nH]1.CC(C)c1ccc2cccc(F)c2n1.CC(C)c1ccc2cccnc2n1.CC(C)c1cccc(F)c1C(F)(F)F.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2c1CCCN2.CC(C)c1cccc2c1OCO2.CC(C)c1cccc2ccncc12.CC(C)c1cccc2ccnn12.CC(C)c1ccccc1S(N)(=O)=O.COc1cc2c(cc1C(C)C)CCC2.Cc1cc(C)n2c(C(C)C)nnc2n1.Cc1ccc(C(C)C)c(Cl)c1.Cc1ccc(C)c2c(C)c(C(C)C)[nH]c12.Cc1ccc(S(C)(=O)=O)cc1C(C)C.Cc1ccc(S(N)(=O)=O)cc1C(C)C.Cc1nc2cc(F)cc(C(C)C)c2nc1C.Cc1noc(-c2ccccc2C(C)C)n1.
What is the InChIKey of 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole?
The InChIKey is AYKCHERIONKGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N.C13H15FN2.C13H18O.C12H13F2NO.C12H12FN.C12H14N2O.C12H17N.C12H13N.C11H13FO2.C11H12N2.C11H16O2S.C10H11ClN2.C10H13Cl.C10H10F4.C10H14N4.2C10H12N2.C10H15NO2S.C10H12O2.C9H13NO2S/c1-8(2)13-11(5)12-9(3)6-7-10(4)14(12)15-13;1-7(2)11-5-10(14)6-12-13(11)16-9(4)8(3)15-12;1-9(2)12-7-10-5-4-6-11(10)8-13(12)14-3;1-7(2)10-6-8-9(15-10)4-3-5-11(8)16-12(13)14;1-8(2)11-7-6-9-4-3-5-10(13)12(9)14-11;1-8(2)10-6-4-5-7-11(10)12-13-9(3)14-15-12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-5-3-4-10-6-7-13-8-12(10)11;1-7(2)10-4-9(12)3-8-5-13-6-14-11(8)10;1-8(2)10-6-5-9-4-3-7-12-11(9)13-10;1-8(2)11-7-10(14(4,12)13)6-5-9(11)3;1-7(2)9-10(11)12-8-5-3-4-6-13(8)9;1-7(2)9-5-4-8(3)6-10(9)11;1-6(2)7-4-3-5-8(11)9(7)10(12,13)14;1-6(2)9-12-13-10-11-7(3)5-8(4)14(9)10;1-8(2)10-5-3-4-9-6-7-11-12(9)10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)10-6-9(14(11,12)13)5-4-8(10)3;1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)8-5-3-4-6-9(8)13(10,11)12/h6-8,15H,1-5H3;5-7H,1-4H3;7-9H,4-6H2,1-3H3;3-7,12,15H,1-2H3;3-8H,1-2H3;4-8H,1-3H3;3,5,7,9,13H,4,6,8H2,1-2H3;3-9H,1-2H3;3-4,7H,5-6H2,1-2H3;3-8H,1-2H3;5-8H,1-4H3;3-7H,1-2H3;4-7H,1-3H3;3-6H,1-2H3;5-6H,1-4H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4-7H,1-3H3,(H2,11,12,13);3-5,7H,6H2,1-2H3;3-7H,1-2H3,(H2,10,11,12).
What are the key properties of 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole?
2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole has a molecular weight of 3810.87 g/mol, XLogP of 59.83, 27 rotatable bonds, 6 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-1-propan-2-ylbenzene;2-chloro-3-propan-2-ylimidazo[1,2-a]pyridine;4-(difluoromethoxy)-2-propan-2-yl-1H-indole;5,7-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine;7-fluoro-2,3-dimethyl-5-propan-2-ylquinoxaline;6-fluoro-8-propan-2-yl-4H-1,3-benzodioxine;8-fluoro-2-propan-2-ylquinoline;1-fluoro-3-propan-2-yl-2-(trifluoromethyl)benzene;5-methoxy-6-propan-2-yl-2,3-dihydro-1H-indene;1-methyl-4-methylsulfonyl-2-propan-2-ylbenzene;4-methyl-3-propan-2-ylbenzenesulfonamide;3-methyl-5-(2-propan-2-ylphenyl)-1,2,4-oxadiazole;2-propan-2-ylbenzenesulfonamide;4-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzodioxole;8-propan-2-ylisoquinoline;2-propan-2-yl-1,8-naphthyridine;7-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yl-1,2,3,4-tetrahydroquinoline;3,4,7-trimethyl-2-propan-2-yl-1H-indole is sourced from PubChem (CID 157269778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).