6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine

C202H237N37O2S4 — CID 157185454

IUPAC6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)C1=CC2=NNCN2C=C1.CC(C)c1ccc2c(c1)CCC2.CC(C)c1ccc2c(c1)SCC2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cnccc2n1.CC(C)c1ccc2nc[nH]c2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccn2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1ccc2ncnn2c1.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccc2nncn2c1.CC(C)c1ccc2nonc2c1.CC(C)c1ccc2nscc2c1.CC(C)c1ccc2nsnc2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2n1.CC(C)c1cnc2ncccc2n1
InChIInChI=1S/2C12H13N.C12H16.2C11H12N2.C11H14S.C10H11N3.3C10H12N2.C10H11NO.2C10H11NS.C9H11N3.C9H13N3.3C9H11N3.C9H10N2O.C9H10N2S/c1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-9(2)11-7-6-10-4-3-5-12(10)8-11;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)10-4-3-9-7-12-6-5-11(9)13-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-7(2)9-6-12-10-8(13-9)4-3-5-11-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-8(2)9-3-4-10-11-5-6-12(10)7-9;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-3-4-10-9(5-8)6-12-11-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-4-6-12-9(11-8)3-5-10-12;1-7(2)8-3-4-12-6-10-11-9(12)5-8;1-7(2)8-3-4-9-11-10-6-12(9)5-8;1-7(2)8-3-4-9-10-6-11-12(9)5-8;1-7(2)8-3-4-9-10-5-6-12(9)11-8;2*1-6(2)7-3-4-8-9(5-7)11-12-10-8/h2*3-9H,1-2H3;6-9H,3-5H2,1-2H3;2*3-8H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);3-8H,1-2H3;4*3-7H,1-2H3;3-5,7,10H,6H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3
InChIKeyAPBJQXHQHLQVMM-UHFFFAOYSA-N
MW3343.64 g/mol
LogP52.36
Rot. Bonds20

About 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine

6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 157185454) has the molecular formula C202H237N37O2S4 and a molecular weight of 3343.64 g/mol. Its IUPAC name is 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID157185454
Molecular FormulaC202H237N37O2S4
Molecular Weight3343.64 g/mol
Exact Mass3340.85
IUPAC Name6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)C1=CC2=NNCN2C=C1.CC(C)c1ccc2c(c1)CCC2.CC(C)c1ccc2c(c1)SCC2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cnccc2n1.CC(C)c1ccc2nc[nH]c2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccn2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1ccc2ncnn2c1.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccc2nncn2c1.CC(C)c1ccc2nonc2c1.CC(C)c1ccc2nscc2c1.CC(C)c1ccc2nsnc2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2n1.CC(C)c1cnc2ncccc2n1
InChIInChI=1S/2C12H13N.C12H16.2C11H12N2.C11H14S.C10H11N3.3C10H12N2.C10H11NO.2C10H11NS.C9H11N3.C9H13N3.3C9H11N3.C9H10N2O.C9H10N2S/c1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-9(2)11-7-6-10-4-3-5-12(10)8-11;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)10-4-3-9-7-12-6-5-11(9)13-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-7(2)9-6-12-10-8(13-9)4-3-5-11-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-8(2)9-3-4-10-11-5-6-12(10)7-9;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-3-4-10-9(5-8)6-12-11-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-4-6-12-9(11-8)3-5-10-12;1-7(2)8-3-4-12-6-10-11-9(12)5-8;1-7(2)8-3-4-9-11-10-6-12(9)5-8;1-7(2)8-3-4-9-10-6-11-12(9)5-8;1-7(2)8-3-4-9-10-5-6-12(9)11-8;2*1-6(2)7-3-4-8-9(5-7)11-12-10-8/h2*3-9H,1-2H3;6-9H,3-5H2,1-2H3;2*3-8H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);3-8H,1-2H3;4*3-7H,1-2H3;3-5,7,10H,6H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3
InChIKeyAPBJQXHQHLQVMM-UHFFFAOYSA-N
XLogP52.36
TPSA444.19 Ų
H-Bond Donors2
H-Bond Acceptors42
Rotatable Bonds20
Heavy Atoms245
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003343.64
LogP ≤ 552.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1042

Analyze 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine with MolForge

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Related Compounds

1-methoxy-3-propan-2-ylbenzene;6-propan-2-yl-1H-benzimidazol-2-amine;6-propan-2-yl-1,3-benzothiazol-2-amine;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2H-benzotriazole;6-propan-2-yl-1,2-benzoxazol-3-amine;6-propan-2-yl-1,3-benzoxazol-2-amine;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-8-(trifluoromethyl)quinoline
CID 157276904
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
N-(1,5-dimethylbenzimidazol-2-yl)acetamide;N-(1,5-dimethylbenzimidazol-2-yl)methanesulfonamide;1,3-dimethyl-5-(trifluoromethyl)benzene;5-fluoro-2-methyl-1-benzofuran;5-fluoro-2-methyl-1-benzothiophene;5-fluoro-2-methyl-1H-indole;N-(6-methyl-1H-benzimidazol-2-yl)acetamide;N-(6-methyl-1H-benzimidazol-2-yl)methanesulfonamide;6-methyl-1,2-benzothiazole;N-(5-methyl-1,3-benzothiazol-2-yl)acetamide;N-(5-methyl-1,3-benzothiazol-2-yl)methanesulfonamide;6-methyl-1,2-benzoxazole;N-(5-methyl-1,3-benzoxazol-2-yl)acetamide;N-(5-methyl-1,3-benzoxazol-2-yl)methanesulfonamide;2-methylfuro[2,3-b]pyridine;3-methyl-2H-indazole;6-methyl-1H-indazole;3-methyl-1,5-naphthyridine;2-methyl-1H-pyrrolo[2,3-b]pyridine;6-methylquinoline;7-methylquinoline;6-methylquinoxaline;2-methylthieno[2,3-b]pyridine
CID 157645993
N-(1,5-dimethylbenzimidazol-2-yl)acetamide;N-(1,5-dimethylbenzimidazol-2-yl)methanesulfonamide;1,3-dimethyl-5-(trifluoromethyl)benzene;5-fluoro-2-methyl-1-benzofuran;5-fluoro-2-methyl-1-benzothiophene;5-fluoro-2-methyl-1H-indole;N-(6-methyl-1H-benzimidazol-2-yl)acetamide;N-(6-methyl-1H-benzimidazol-2-yl)methanesulfonamide;6-methyl-1,2-benzothiazole;N-(5-methyl-1,3-benzothiazol-2-yl)acetamide;N-(5-methyl-1,3-benzothiazol-2-yl)methanesulfonamide;6-methyl-1,2-benzoxazole;N-(5-methyl-1,3-benzoxazol-2-yl)acetamide;N-(5-methyl-1,3-benzoxazol-2-yl)methanesulfonamide;2-methylfuro[2,3-b]pyridine;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-b]pyridine;6-methylquinoline;2-methylthieno[2,3-b]pyridine
CID 158749319
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
N-(1,5-dimethylbenzimidazol-2-yl)acetamide;N-(1,5-dimethylbenzimidazol-2-yl)methanesulfonamide;1,3-dimethyl-5-(trifluoromethyl)benzene;5-fluoro-2-methyl-1-benzofuran;5-fluoro-2-methyl-1-benzothiophene;5-fluoro-2-methyl-1H-indole;N-(6-methyl-1H-benzimidazol-2-yl)acetamide;N-(6-methyl-1H-benzimidazol-2-yl)methanesulfonamide;6-methyl-1,2-benzothiazole;N-(5-methyl-1,3-benzothiazol-2-yl)acetamide;N-(5-methyl-1,3-benzothiazol-2-yl)methanesulfonamide;6-methyl-1,2-benzoxazole;N-(5-methyl-1,3-benzoxazol-2-yl)acetamide;N-(5-methyl-1,3-benzoxazol-2-yl)methanesulfonamide;2-methylfuro[2,3-b]pyridine;3-methyl-2H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-b]pyridine;6-methylquinoline;7-methylquinoline;6-methylquinoxaline;2-methylthieno[2,3-b]pyridine
CID 159667227
CID 159796127
CID 159796127
CID 160156765
CID 160156765
6-methyl-1H-benzimidazole;5-methyl-2,1,3-benzothiadiazole;5-methyl-1,3-benzothiazole;6-methyl-1,3-benzothiazole;bis(5-methyl-2H-benzotriazole);6-methyl-1,3-benzoxazole;5-methyl-2,3-dihydro-1H-indole;5-methyl-1H-indazol-3-amine;5-methyl-1H-indazole;5-methyl-1H-indole;6-methyl-2-(trifluoromethyl)-1H-benzimidazole
CID 160297141
N,N-dimethyl-6-propan-2-yl-1H-benzimidazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzothiazol-2-amine;N,N-dimethyl-6-propan-2-yl-1,2-benzoxazol-3-amine;N,N-dimethyl-6-propan-2-yl-1,3-benzoxazol-2-amine;1,2-dimethyl-6-propan-2-yl-1-(trifluoromethyl)-3,4-dihydroisoquinoline;1-methyl-6-propan-2-yl-1-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]oxazolo[4,5-c]pyridine;2-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;3-propan-2-yl-5,6,7,8-tetrahydropyrido[3,4-b]pyrazine;2-propan-2-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydro-[1,3]thiazolo[4,5-c]pyridine;2-propan-2-yl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 160944258
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;5-(1,1-difluoroethyl)-1-methylpyrazole;5-(1,1-difluoroethyl)-1H-pyrazole;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1-(3,4-dimethylphenyl)pyrazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methoxypyridine;6-methylimidazo[1,2-a]pyridine;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;bis(1H-pyrrolo[3,2-c]pyridine);1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine;thiophene;1,3,5-triazine;2-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 161043810
1-cyclopentyl-3-propan-2-ylbenzene;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;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[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 161044231

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine (CID 157185454) is 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine is CC(C)C1=CC2=NNCN2C=C1.CC(C)c1ccc2c(c1)CCC2.CC(C)c1ccc2c(c1)SCC2.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cnccc2n1.CC(C)c1ccc2nc[nH]c2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nccn2c1.CC(C)c1ccc2nccn2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1ccc2ncnn2c1.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccc2nncn2c1.CC(C)c1ccc2nonc2c1.CC(C)c1ccc2nscc2c1.CC(C)c1ccc2nsnc2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2n1.CC(C)c1cnc2ncccc2n1.
What is the InChIKey of 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is APBJQXHQHLQVMM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H13N.C12H16.2C11H12N2.C11H14S.C10H11N3.3C10H12N2.C10H11NO.2C10H11NS.C9H11N3.C9H13N3.3C9H11N3.C9H10N2O.C9H10N2S/c1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;1-9(2)11-7-6-10-4-3-5-12(10)8-11;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)10-4-3-9-7-12-6-5-11(9)13-10;1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-7(2)9-6-12-10-8(13-9)4-3-5-11-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-8(2)9-3-4-10-11-5-6-12(10)7-9;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-3-4-10-9(5-8)6-12-11-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-7(2)8-4-6-12-9(11-8)3-5-10-12;1-7(2)8-3-4-12-6-10-11-9(12)5-8;1-7(2)8-3-4-9-11-10-6-12(9)5-8;1-7(2)8-3-4-9-10-6-11-12(9)5-8;1-7(2)8-3-4-9-10-5-6-12(9)11-8;2*1-6(2)7-3-4-8-9(5-7)11-12-10-8/h2*3-9H,1-2H3;6-9H,3-5H2,1-2H3;2*3-8H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,11,12);3-8H,1-2H3;4*3-7H,1-2H3;3-5,7,10H,6H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3.
What are the key properties of 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 3343.64 g/mol, XLogP of 52.36, 20 rotatable bonds, 2 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-2,1,3-benzothiadiazole;5-propan-2-yl-2,1-benzothiazole;6-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-2,1,3-benzoxadiazole;6-propan-2-yl-1,3-benzoxazole;6-propan-2-yl-2,3-dihydro-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-2,3-dihydro-[1,2,4]triazolo[4,3-a]pyridine;6-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-1,6-naphthyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyrimidine;2-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 157185454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).