2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene

C259H376N26O8S11 — CID 157492790

IUPAC2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=CCC=C1.CC(C)c1cc2ccccc2[nH]1.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccnc2ccccc12.CC(C)c1ccns1.CC(C)c1ccon1.CC(C)c1cn2ccccc2n1.CC(C)c1cocn1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2cccnc2s1.CC(C)c1nc2ncccc2s1.CC(C)c1ncc2ccccc2n1.CC(C)c1nccc2ccccc12.CC(C)c1ncco1.CC(C)c1nccs1.Cc1cc(C(C)C)no1.Cc1ccsc1C(C)C.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)o1
InChIInChI=1S/3C12H13N.C11H12N2.C11H13N.C11H12O.C11H12S.2C10H12N2.C10H11NO.3C10H11NS.2C9H10N2S.C8H13NO.C8H12S.C8H12.C7H11NO.C7H11NS.C7H10O.C7H10S.3C6H9NO.2C6H9NS.19CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-9(2)12-11-6-4-3-5-10(11)7-8-13-12;1-8(2)11-12-7-9-5-3-4-6-10(9)13-11;3*1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-7-12-6-4-3-5-10(12)11-9;5*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)9-11-8-7(12-9)4-3-5-10-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-5(2)8-6(3)10-7(4)9-8;1-6(2)8-7(3)4-5-9-8;1-7(2)8-5-3-4-6-8;1-5(2)7-4-6(3)9-8-7;1-5(2)7-8-6(3)4-9-7;2*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;;;;;;;;;;;;;;;;;;;/h3*3-9H,1-2H3;3-8H,1-2H3;3-8,12H,1-2H3;3*3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4*3-7H,1-2H3;2*3-6H,1-2H3;5H,1-4H3;4-6H,1-3H3;3,5-7H,4H2,1-2H3;2*4-5H,1-3H3;2*3-6H,1-2H3;5*3-5H,1-2H3;19*1H4
InChIKeyBXMBFFWAGPWBQT-UHFFFAOYSA-N
MW4334.77 g/mol
LogP87.78
Rot. Bonds27

About 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene

2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene (PubChem CID 157492790) has the molecular formula C259H376N26O8S11 and a molecular weight of 4334.77 g/mol. Its IUPAC name is 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene.

Molecular Properties

Compound Name2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene
PubChem CID157492790
Molecular FormulaC259H376N26O8S11
Molecular Weight4334.77 g/mol
Exact Mass4330.67
IUPAC Name2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=CCC=C1.CC(C)c1cc2ccccc2[nH]1.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccnc2ccccc12.CC(C)c1ccns1.CC(C)c1ccon1.CC(C)c1cn2ccccc2n1.CC(C)c1cocn1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2cccnc2s1.CC(C)c1nc2ncccc2s1.CC(C)c1ncc2ccccc2n1.CC(C)c1nccc2ccccc12.CC(C)c1ncco1.CC(C)c1nccs1.Cc1cc(C(C)C)no1.Cc1ccsc1C(C)C.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)o1
InChIInChI=1S/3C12H13N.C11H12N2.C11H13N.C11H12O.C11H12S.2C10H12N2.C10H11NO.3C10H11NS.2C9H10N2S.C8H13NO.C8H12S.C8H12.C7H11NO.C7H11NS.C7H10O.C7H10S.3C6H9NO.2C6H9NS.19CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-9(2)12-11-6-4-3-5-10(11)7-8-13-12;1-8(2)11-12-7-9-5-3-4-6-10(9)13-11;3*1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-7-12-6-4-3-5-10(12)11-9;5*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)9-11-8-7(12-9)4-3-5-10-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-5(2)8-6(3)10-7(4)9-8;1-6(2)8-7(3)4-5-9-8;1-7(2)8-5-3-4-6-8;1-5(2)7-4-6(3)9-8-7;1-5(2)7-8-6(3)4-9-7;2*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;;;;;;;;;;;;;;;;;;;/h3*3-9H,1-2H3;3-8H,1-2H3;3-8,12H,1-2H3;3*3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4*3-7H,1-2H3;2*3-6H,1-2H3;5H,1-4H3;4-6H,1-3H3;3,5-7H,4H2,1-2H3;2*4-5H,1-3H3;2*3-6H,1-2H3;5*3-5H,1-2H3;19*1H4
InChIKeyBXMBFFWAGPWBQT-UHFFFAOYSA-N
XLogP87.78
TPSA437.58 Ų
H-Bond Donors2
H-Bond Acceptors43
Rotatable Bonds27
Heavy Atoms304
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004334.77
LogP ≤ 587.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1043

Analyze 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene with MolForge

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Launch Full Analysis

Related Compounds

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
1,3-benzothiazole;1-benzothiophene;6-chloroimidazo[1,2-a]pyridine;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1-(3,4-dimethylphenyl)pyrazole;3,5-dimethylpyridine;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;2-methoxypyridine;3-methoxypyridine;2-methyl-1H-imidazole;bis(1-methylindazole);2-methylpyrimidine;1-methylpyrrolo[2,3-c]pyridine;1-methyl-5-(trifluoromethyl)pyrazole;1,2-oxazole;1,3-oxazole;1-propylpyrazole;pyrazine;1H-pyrazole;1H-pyrazolo[5,4-b]pyridine;pyridazine;pyridine;pyrido[4,3-b][1,6]naphthyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-c]pyridine;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;5-(trifluoromethyl)-1H-pyrazole
CID 157712548
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;6-chloroimidazo[1,2-a]pyridine;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;3,5-dimethylpyridine;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;methane;2-methoxypyridine;3-methoxypyridine;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;1H-pyrazolo[5,4-b]pyridine;pyridazine;pyridine;bis(pyrimidine);1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-c]pyridine;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 157989050
2-tert-butyl-4-chloro-1-methylbenzene;1-tert-butyl-4-methylbenzene;4-chloro-1-methyl-2-(trifluoromethyl)benzene;4-chloro-2-methyl-1-(trifluoromethyl)benzene;1,2-dimethylbenzimidazole;1,2-dimethylindole;5-fluoro-2-methyl-1,3-benzoxazole;6-fluoro-2-methylquinazoline;1-methyladamantane;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;3-methyl-1,2-benzothiazole;2-methyl-1-benzothiophene;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;1-methylbicyclo[2.2.1]heptane;(2S)-2-methylbicyclo[2.2.1]heptane;1-methylisoquinoline;1-methylnaphthalene;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;1-methyl-2-(trifluoromethyl)benzene;1-methyl-3-(trifluoromethyl)benzene
CID 158056583
benzo[b][1,6]naphthyridine;1,3-benzothiazole;1-benzothiophene;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;furan;furo[2,3-c]pyridine;imidazo[1,2-a]pyridine;1H-imidazole;1H-indazole;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;pyrimidine;1H-pyrrole;5H-pyrrolo[1,2-a]imidazole;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[2,3-c]pyridine;1H-pyrrolo[3,2-c]pyridine;1,2-thiazole;1,3-thiazole;thieno[2,3-b]pyridine;thieno[3,2-b]thiophene;bis(thieno[2,3-c]pyridine);thiophene;1,3,5-triazine;5-(trifluoromethyl)-1H-pyrazole
CID 158113572
1H-benzimidazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzothiazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-piperidin-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-pyrrol-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 158306259
benzaldehyde;benzonitrile;1,3-benzothiazole;1-benzothiophene;1,3-benzoxazole;2-(1,1-difluoroethyl)-1,3-bis(trifluoromethyl)benzene;3H-indole;4-methylidenecyclopent-2-en-1-one;4H-naphthalen-1-one;1,6-naphthyridine;phenanthridine;1H-phenanthro[9,10-d]imidazole;1,10-phenanthroline;2-phenyl-1,3-benzoxazole;2-pyridin-2-ylpyridine;quinoline
CID 158538440
CID 158592718
CID 158592718
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
cumene;methane;2-methyl-5-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;5-propan-2-yl-1,2,4-oxadiazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;bis(5-propan-2-yl-1H-pyrazole);bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1,2,4-thiadiazole;bis(2-propan-2-yl-1,3-thiazole);bis(2-propan-2-ylthiophene);2-propan-2-yl-5-(trifluoromethyl)-1,3-thiazole
CID 159939351

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene?
The IUPAC name of 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene (CID 157492790) is 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene.
What is the SMILES notation for 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene?
The canonical SMILES for 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=CCC=C1.CC(C)c1cc2ccccc2[nH]1.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1cc2ccccc2s1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccnc2ccccc12.CC(C)c1ccns1.CC(C)c1ccon1.CC(C)c1cn2ccccc2n1.CC(C)c1cocn1.CC(C)c1nc2ccccc2[nH]1.CC(C)c1nc2ccccc2o1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2ccccc2s1.CC(C)c1nc2cccnc2s1.CC(C)c1nc2ncccc2s1.CC(C)c1ncc2ccccc2n1.CC(C)c1nccc2ccccc12.CC(C)c1ncco1.CC(C)c1nccs1.Cc1cc(C(C)C)no1.Cc1ccsc1C(C)C.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)o1.
What is the InChIKey of 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene?
The InChIKey is BXMBFFWAGPWBQT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H13N.C11H12N2.C11H13N.C11H12O.C11H12S.2C10H12N2.C10H11NO.3C10H11NS.2C9H10N2S.C8H13NO.C8H12S.C8H12.C7H11NO.C7H11NS.C7H10O.C7H10S.3C6H9NO.2C6H9NS.19CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-9(2)12-11-6-4-3-5-10(11)7-8-13-12;1-8(2)11-12-7-9-5-3-4-6-10(9)13-11;3*1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-8(2)9-7-12-6-4-3-5-10(12)11-9;5*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-6(2)9-11-8-7(12-9)4-3-5-10-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-5(2)8-6(3)10-7(4)9-8;1-6(2)8-7(3)4-5-9-8;1-7(2)8-5-3-4-6-8;1-5(2)7-4-6(3)9-8-7;1-5(2)7-8-6(3)4-9-7;2*1-6(2)7-4-3-5-8-7;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;;;;;;;;;;;;;;;;;;;/h3*3-9H,1-2H3;3-8H,1-2H3;3-8,12H,1-2H3;3*3-8H,1-2H3;3-7H,1-2H3,(H,11,12);4*3-7H,1-2H3;2*3-6H,1-2H3;5H,1-4H3;4-6H,1-3H3;3,5-7H,4H2,1-2H3;2*4-5H,1-3H3;2*3-6H,1-2H3;5*3-5H,1-2H3;19*1H4.
What are the key properties of 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene?
2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene has a molecular weight of 4334.77 g/mol, XLogP of 87.78, 27 rotatable bonds, 2 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-propan-2-yl-1,3-oxazole;methane;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-2-propan-2-yl-1,3-thiazole;3-methyl-2-propan-2-ylthiophene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1-benzofuran;tris(2-propan-2-yl-1,3-benzothiazole);2-propan-2-yl-1-benzothiophene;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylcyclopenta-1,3-diene;2-propan-2-ylfuran;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-indole;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;2-propan-2-ylquinazoline;4-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;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-ylthiophene is sourced from PubChem (CID 157492790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).