2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C215H297N25O3S2 — CID 157446805

IUPAC2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCC.CC.CC.CC.CC.CC(C)c1cc(Cc2ccccc2)no1.CC(C)c1cnc2ccccn12.CC(C)c1cnc2ccccn12.CC(C)c1cnc2n1CCCC2.CCc1[nH]c(Cc2ccccc2)nc1C(C)C.CCc1nc(Cc2ccccc2)cn1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc2ccccc2c1C(C)C
InChIInChI=1S/6C15H20N2.2C15H19NO.2C15H19NS.C13H15NO.C12H16N2.C10H16N2.2C10H12N2.5C2H6/c2*1-4-15-14(12(2)3)11-17(16-15)10-13-8-6-5-7-9-13;2*1-4-17-15(12(2)3)11-14(16-17)10-13-8-6-5-7-9-13;1-4-15-16-14(11-17(15)12(2)3)10-13-8-6-5-7-9-13;5*1-4-13-15(11(2)3)17-14(16-13)10-12-8-6-5-7-9-12;1-10(2)13-9-12(14-15-13)8-11-6-4-3-5-7-11;1-4-14-12(9(2)3)10-7-5-6-8-11(10)13-14;3*1-8(2)9-7-11-10-5-3-4-6-12(9)10;5*1-2/h5*5-9,11-12H,4,10H2,1-3H3;5-9,11H,4,10H2,1-3H3,(H,16,17);4*5-9,11H,4,10H2,1-3H3;3-7,9-10H,8H2,1-2H3;5-9H,4H2,1-3H3;7-8H,3-6H2,1-2H3;2*3-8H,1-2H3;5*1-2H3
InChIKeyBSHZESMYJNOJES-UHFFFAOYSA-N
MW3344.05 g/mol
LogP57.47
Rot. Bonds48

About 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 157446805) has the molecular formula C215H297N25O3S2 and a molecular weight of 3344.05 g/mol. Its IUPAC name is 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID157446805
Molecular FormulaC215H297N25O3S2
Molecular Weight3344.05 g/mol
Exact Mass3341.33
IUPAC Name2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCC.CC.CC.CC.CC.CC(C)c1cc(Cc2ccccc2)no1.CC(C)c1cnc2ccccn12.CC(C)c1cnc2ccccn12.CC(C)c1cnc2n1CCCC2.CCc1[nH]c(Cc2ccccc2)nc1C(C)C.CCc1nc(Cc2ccccc2)cn1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc2ccccc2c1C(C)C
InChIInChI=1S/6C15H20N2.2C15H19NO.2C15H19NS.C13H15NO.C12H16N2.C10H16N2.2C10H12N2.5C2H6/c2*1-4-15-14(12(2)3)11-17(16-15)10-13-8-6-5-7-9-13;2*1-4-17-15(12(2)3)11-14(16-17)10-13-8-6-5-7-9-13;1-4-15-16-14(11-17(15)12(2)3)10-13-8-6-5-7-9-13;5*1-4-13-15(11(2)3)17-14(16-13)10-12-8-6-5-7-9-12;1-10(2)13-9-12(14-15-13)8-11-6-4-3-5-7-11;1-4-14-12(9(2)3)10-7-5-6-8-11(10)13-14;3*1-8(2)9-7-11-10-5-3-4-6-12(9)10;5*1-2/h5*5-9,11-12H,4,10H2,1-3H3;5-9,11H,4,10H2,1-3H3,(H,16,17);4*5-9,11H,4,10H2,1-3H3;3-7,9-10H,8H2,1-2H3;5-9H,4H2,1-3H3;7-8H,3-6H2,1-2H3;2*3-8H,1-2H3;5*1-2H3
InChIKeyBSHZESMYJNOJES-UHFFFAOYSA-N
XLogP57.47
TPSA291.89 Ų
H-Bond Donors1
H-Bond Acceptors29
Rotatable Bonds48
Heavy Atoms245
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003344.05
LogP ≤ 557.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1029

Analyze 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine with MolForge

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Launch Full Analysis

Related Compounds

1-(3-chloro-1,2-oxazol-5-yl)-4-methylpentan-3-one;1-(1,1-dioxothiolan-3-yl)-3-methylbutan-2-one;1-imidazo[1,2-a]pyrimidin-2-yl-4-methylpentan-3-one;methane;1-(5-methoxy-2-methyl-1H-indol-3-yl)-3-methylbutan-2-one;3-methyl-1-(5-methyl-2-phenyl-1,3-oxazol-4-yl)butan-2-one;3-methyl-1-(5-methyl-2-phenyl-1,3-thiazol-4-yl)butan-2-one;2-(3-methyl-2-oxobutyl)-6-phenyl-4,5-dihydropyridazin-3-one;3-methyl-1-(4-pyridin-2-yltriazol-1-yl)butan-2-one;4-methyl-1-pyrimidin-5-ylpentan-3-one;3-methyl-1-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]butan-2-one
CID 158313228
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
2-[4-(furan-2-yl)-2-(1H-imidazol-2-yl)-5-(1H-indol-2-yl)-2-(4-naphthalen-1-yl-5-phenyl-1H-pyrazol-3-yl)-6-(1,2-oxazol-3-yl)-3-phenylsulfanyl-6-(1H-pyrrol-2-yl)-3-(1H-tetrazol-5-yl)-5-(1,3-thiazol-2-yl)-4-(1H-triazol-4-yl)piperidin-1-yl]-1,3-oxazole
CID 141454607
3-tert-butylimidazo[1,2-a]pyridine;ethane;methane;4-propan-2-yl-1H-benzimidazole;6-propan-2-yl-1H-benzimidazole;7-propan-2-yl-1-benzofuran;3-propan-2-yl-1-benzothiophene;3-propan-2-yl-1,2-benzoxazole;7-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1H-indazole;3-propan-2-yl-1H-indole;7-propan-2-yl-1H-indole;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole
CID 157085230
tert-butylbenzene;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;2-tert-butyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine;2-tert-butylfuran;2-tert-butylimidazo[1,2-a]pyridine;2-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-1H-imidazole;5-tert-butyl-1H-imidazole;4-tert-butyloxane;3-tert-butyl-1,2-oxazole;4-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;3-tert-butyloxolane;2-tert-butylpyrazine;5-tert-butyl-1H-pyrazole;2-tert-butylpyrazolo[1,5-a]pyridine;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;4-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene;4-methyl-1H-pyrazole;2-methylpyrazolo[1,5-a]pyridine
CID 157085631
benzene;1-benzofuran;1-benzothiophene;cyclopenta-1,3-diene;1,2-dihydrocinnoline;furan;imidazo[1,2-a]pyridine;1H-imidazole;1H-indene;indolizine;isoquinoline;naphthalene;1,2-oxazole;1,3-oxazole;pyrazine;3H-pyrazole;pyrazolo[1,5-a]pyridine;pyridazine;pyridine;pyrimidine;1H-pyrrole;3H-pyrrole;quinoline;quinoxaline;1,2-thiazole;1,3-thiazole;thiophene
CID 157091306
1H-benzimidazole;1-benzofuran;1,3-benzothiazole;1-benzothiophene;2H-benzotriazole;1,2-benzoxazole;1,3-benzoxazole;furo[2,3-b]pyridine;1H-indazole;1H-indole;octadecakis(2-methylpropane);[1,3]oxazolo[4,5-b]pyridine;[1,3]oxazolo[5,4-c]pyridine;1H-pyrrolo[2,3-b]pyridine;quinazoline;quinoline;[1,3]thiazolo[4,5-b]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyridine
CID 157175988
methane;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-ylbenzotriazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-ylfuro[2,3-b]pyridine;2-propan-2-yl-[1,3]oxazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]oxazolo[5,4-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;2-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine;2-propan-2-ylthieno[2,3-b]pyridine
CID 157217197
1,4-di(propan-2-yl)imidazole;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)-1,3,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;bis(3,5-di(propan-2-yl)-1,2-oxazole);1,3-di(propan-2-yl)pyrazole;3,5-di(propan-2-yl)-1H-pyrazole;3,5-di(propan-2-yl)pyridazine;2,4-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)-1,3,4-thiadiazole;2,5-di(propan-2-yl)-1,3-thiazole;1,3-di(propan-2-yl)-1,2,4-triazole;1,4-di(propan-2-yl)triazole;2,4-di(propan-2-yl)triazole;3,5-di(propan-2-yl)-1H-1,2,4-triazole
CID 157260896
4-methyl-2-propan-2-yl-1,3-benzothiazole;1-methyl-4-propan-2-ylpyrazolo[3,4-d]pyrimidine;7-methyl-4-propan-2-ylpyrrolo[2,3-d]pyrimidine;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;4-propan-2-yl-7H-cyclopenta[d]pyrimidine;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;7-propan-2-yl-1H-pyrazolo[4,5-d]pyrimidine;4-propan-2-yl-7H-pyrrolo[3,4-d]pyrimidine
CID 157264548
3aH-benzotriazole;1H-benzimidazole;1-benzofuran;1,2,3-benzothiadiazole;2,1,3-benzothiadiazole;1-benzothiophene;1,2-benzoxazole;1,3-benzoxazole;9H-carbazole;dibenzofuran;2,3-dihydro-1H-pyrrolo[1,2-a]indole;imidazo[1,2-a]pyridine;1H-indazole;bis(1H-indole);hexadecakis(2-methylpropane);quinoline
CID 157265570
2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;3-propan-2-ylcinnoline;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-propan-2-yl-2,3-dihydropyrrolo[2,3-b]pyridine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylisoindole-1,3-dione;2-propan-2-yl-3H-isoindol-1-one;1-propan-2-ylisoquinoline;3-propan-2-ylisoquinoline;2-propan-2-yl-1,5-naphthyridine;2-propan-2-yl-1,8-naphthyridine;2-propan-2-ylpteridine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-propan-2-ylquinazoline;2-propan-2-ylquinoline;2-propan-2-ylquinoxaline
CID 157265838

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 157446805) is 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is CC.CC.CC.CC.CC.CC(C)c1cc(Cc2ccccc2)no1.CC(C)c1cnc2ccccn12.CC(C)c1cnc2ccccn12.CC(C)c1cnc2n1CCCC2.CCc1[nH]c(Cc2ccccc2)nc1C(C)C.CCc1nc(Cc2ccccc2)cn1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)oc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nc(Cc2ccccc2)sc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCc1nn(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc(Cc2ccccc2)cc1C(C)C.CCn1nc2ccccc2c1C(C)C.
What is the InChIKey of 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is BSHZESMYJNOJES-UHFFFAOYSA-N. The full InChI is InChI=1S/6C15H20N2.2C15H19NO.2C15H19NS.C13H15NO.C12H16N2.C10H16N2.2C10H12N2.5C2H6/c2*1-4-15-14(12(2)3)11-17(16-15)10-13-8-6-5-7-9-13;2*1-4-17-15(12(2)3)11-14(16-17)10-13-8-6-5-7-9-13;1-4-15-16-14(11-17(15)12(2)3)10-13-8-6-5-7-9-13;5*1-4-13-15(11(2)3)17-14(16-13)10-12-8-6-5-7-9-12;1-10(2)13-9-12(14-15-13)8-11-6-4-3-5-7-11;1-4-14-12(9(2)3)10-7-5-6-8-11(10)13-14;3*1-8(2)9-7-11-10-5-3-4-6-12(9)10;5*1-2/h5*5-9,11-12H,4,10H2,1-3H3;5-9,11H,4,10H2,1-3H3,(H,16,17);4*5-9,11H,4,10H2,1-3H3;3-7,9-10H,8H2,1-2H3;5-9H,4H2,1-3H3;7-8H,3-6H2,1-2H3;2*3-8H,1-2H3;5*1-2H3.
What are the key properties of 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 3344.05 g/mol, XLogP of 57.47, 48 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-5-ethyl-4-propan-2-yl-1H-imidazole;4-benzyl-2-ethyl-1-propan-2-ylimidazole;bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-oxazole);bis(1-benzyl-3-ethyl-4-propan-2-ylpyrazole);bis(3-benzyl-1-ethyl-5-propan-2-ylpyrazole);bis(2-benzyl-4-ethyl-5-propan-2-yl-1,3-thiazole);3-benzyl-5-propan-2-yl-1,2-oxazole;ethane;2-ethyl-3-propan-2-ylindazole;bis(3-propan-2-ylimidazo[1,2-a]pyridine);3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 157446805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).