3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole

C258H331F9N28O2 — CID 160590151

IUPAC3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole
SMILESCC(C)(C)c1c(C(F)(F)F)nc2ccccn12.CC(C)(C)c1c(C2CC2)nc2ccccn12.CC(C)(C)c1c(C2CCC2)nc2ccccn12.CC(C)(C)n1c(C(F)(F)F)cc2ccccc21.CC(C)(C)n1c(C(F)(F)F)nc2ncccc21.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C)n(C(C)(C)C)c2ccccc12.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cn(C(C)(C)C)c2ccccc12.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ncccc2n1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C
InChIInChI=1S/C15H20N2.C14H18N2.3C14H19N.C13H14F3N.6C13H17N.2C13H16O.C12H13F3N2.3C12H16N2.C11H12F3N3.C11H15N3/c1-15(2,3)14-13(11-7-6-8-11)16-12-9-4-5-10-17(12)14;1-14(2,3)13-12(10-7-8-10)15-11-6-4-5-9-16(11)13;2*1-10-13(14(2,3)4)11-8-6-7-9-12(11)15(10)5;1-10-11(2)15(14(3,4)5)13-9-7-6-8-12(10)13;1-12(2,3)17-10-7-5-4-6-9(10)8-11(17)13(14,15)16;1-10-9-14(13(2,3)4)12-8-6-5-7-11(10)12;3*1-10-9-11-7-5-6-8-12(11)14(10)13(2,3)4;4*1-9-12(13(2,3)4)10-7-5-6-8-11(10)14-9;1-11(2,3)10-9(12(13,14)15)16-8-6-4-5-7-17(8)10;3*1-9-11(12(2,3)4)14-8-6-5-7-10(14)13-9;1-10(2,3)17-7-5-4-6-15-8(7)16-9(17)11(12,13)14;1-8-13-10-9(6-5-7-12-10)14(8)11(2,3)4/h4-5,9-11H,6-8H2,1-3H3;4-6,9-10H,7-8H2,1-3H3;3*6-9H,1-5H3;4-8H,1-3H3;4*5-9H,1-4H3;2*5-8,14H,1-4H3;2*5-8H,1-4H3;4-7H,1-3H3;3*5-8H,1-4H3;4-6H,1-3H3;5-7H,1-4H3
InChIKeyRCXFHFFTHPDLTK-UHFFFAOYSA-N
MW4027.66 g/mol
LogP72.02
Rot. Bonds2

About 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole

3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole (PubChem CID 160590151) has the molecular formula C258H331F9N28O2 and a molecular weight of 4027.66 g/mol. Its IUPAC name is 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole.

Molecular Properties

Compound Name3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole
PubChem CID160590151
Molecular FormulaC258H331F9N28O2
Molecular Weight4027.66 g/mol
Exact Mass4024.65
IUPAC Name3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole
SMILESCC(C)(C)c1c(C(F)(F)F)nc2ccccn12.CC(C)(C)c1c(C2CC2)nc2ccccn12.CC(C)(C)c1c(C2CCC2)nc2ccccn12.CC(C)(C)n1c(C(F)(F)F)cc2ccccc21.CC(C)(C)n1c(C(F)(F)F)nc2ncccc21.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C)n(C(C)(C)C)c2ccccc12.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cn(C(C)(C)C)c2ccccc12.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ncccc2n1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C
InChIInChI=1S/C15H20N2.C14H18N2.3C14H19N.C13H14F3N.6C13H17N.2C13H16O.C12H13F3N2.3C12H16N2.C11H12F3N3.C11H15N3/c1-15(2,3)14-13(11-7-6-8-11)16-12-9-4-5-10-17(12)14;1-14(2,3)13-12(10-7-8-10)15-11-6-4-5-9-16(11)13;2*1-10-13(14(2,3)4)11-8-6-7-9-12(11)15(10)5;1-10-11(2)15(14(3,4)5)13-9-7-6-8-12(10)13;1-12(2,3)17-10-7-5-4-6-9(10)8-11(17)13(14,15)16;1-10-9-14(13(2,3)4)12-8-6-5-7-11(10)12;3*1-10-9-11-7-5-6-8-12(11)14(10)13(2,3)4;4*1-9-12(13(2,3)4)10-7-5-6-8-11(10)14-9;1-11(2,3)10-9(12(13,14)15)16-8-6-4-5-7-17(8)10;3*1-9-11(12(2,3)4)14-8-6-5-7-10(14)13-9;1-10(2,3)17-7-5-4-6-15-8(7)16-9(17)11(12,13)14;1-8-13-10-9(6-5-7-12-10)14(8)11(2,3)4/h4-5,9-11H,6-8H2,1-3H3;4-6,9-10H,7-8H2,1-3H3;3*6-9H,1-5H3;4-8H,1-3H3;4*5-9H,1-4H3;2*5-8,14H,1-4H3;2*5-8H,1-4H3;4-7H,1-3H3;3*5-8H,1-4H3;4-6H,1-3H3;5-7H,1-4H3
InChIKeyRCXFHFFTHPDLTK-UHFFFAOYSA-N
XLogP72.02
TPSA262.52 Ų
H-Bond Donors2
H-Bond Acceptors28
Rotatable Bonds2
Heavy Atoms297
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004027.66
LogP ≤ 572.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1028

Analyze 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole with MolForge

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Related Compounds

2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tris(6-(2H-dibenzofuran-2-id-3-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium
CID 157398628
bis(6-(3H-dibenzofuran-3-id-4-yl)pyrido[2,3-b]pyrazine);2-(3H-dibenzofuran-3-id-4-yl)quinoline;tris(iridium(3+));bis(9-methyl-1-pyrido[2,3-b]pyrazin-6-yl-2H-carbazol-2-ide);9-methyl-1-quinolin-2-yl-2H-carbazol-2-ide;tris(2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine)
CID 157802126
tris(3-(2H-dibenzofuran-2-id-3-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium;1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium
CID 157860594
2-(3H-dibenzofuran-3-id-2-yl)-1-[2,6-di(propan-2-yl)phenyl]imidazole;3-(2,6-dimethylphenyl)-7-(2,2-dimethylpropyl)-12H-imidazo[1,2-f]phenanthridin-12-ide;1-(2,6-dimethylphenyl)-2-phenylimidazole;1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole;pentakis(iridium);2-phenylpyridine;platinum;2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
CID 158170112
1-(2H-dibenzofuran-2-id-3-yl)-3-methyl-2H-imidazol-2-ide;bis(iridium);bis(iridium(3+));1-methyl-2-phenylimidazole;1-methyl-3-phenyl-2H-imidazol-2-ide;3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]-4H-pyridin-4-ide;tetrakis(N-pyridin-2-ylpyridin-1-id-2-imine)
CID 158740741
2-(4-tert-butylbenzene-6-id-1-yl)pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)pyridine;6-fluoro-9-phenyl-3-[1-(2,4,6-trimethylphenyl)imidazol-2-yl]-2H-carbazol-2-ide;octakis(iridium);2-(8-methyl-3H-dibenzofuran-3-id-2-yl)-1-(2,4,6-trimethylphenyl)imidazole;2-(4-octylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;2-phenyl-5-(trifluoromethyl)pyridine
CID 159232514
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tetrakis(6-(3H-dibenzofuran-3-id-4-yl)pyrido[2,3-b]pyrazine);tetrakis(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;bis(1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium)
CID 159616904
1-(4-tert-butyl-2,6-diphenylphenyl)-2-[7-(4-fluorophenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;[4-[cyclohexyl(dideuterio)methyl]-6-phenyl-3-pyridinyl]-trimethylgermane;tris([4-(2-deuteriopropan-2-yl)-6-phenyl-3-pyridinyl]-trimethylgermane);1-(2,6-diphenylphenyl)-2-[7-(4-fluorophenyl)-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-(2,4-diphenylphenyl)-2-[7-(2-fluorophenyl)-1-phenyl-3H-dibenzofuran-3-id-4-yl]benzimidazole;1-(2,5-diphenylphenyl)-7-fluoro-2-[8-[4-(trifluoromethyl)phenyl]-3H-dibenzofuran-3-id-4-yl]benzimidazole;tetrakis(iridium)
CID 160047734
1-tert-butyl-6-chloro-2-methylbenzimidazole;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);1-tert-butyl-2-ethylbenzimidazole;1-tert-butylimidazo[4,5-b]pyridine;1-tert-butyl-2-methylbenzimidazole;bis(3-tert-butyl-2-methyl-1-benzofuran);3-tert-butyl-2-methylimidazo[1,2-a]pyridine;1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole
CID 160068967
12-(3,4-Difluorophenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-(2-ethylphenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-(4-ethylphenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-(2-fluorophenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-(furan-2-yl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-(2-methylphenyl)-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile;12-[4-(trifluoromethoxy)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile
CID 160564823
3-cyclobutyl-N-[3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]but-1-en-2-yl]-6-methylimidazo[4,5-b]pyridin-2-amine;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-(furan-2-yl)propanamide;N-(3-cyclobutyl-6-methylimidazo[4,5-b]pyridin-2-yl)-3-(oxolan-2-yl)propanamide;(3R)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;(3S)-N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-3-phenylbutanamide;N-(3-cyclobutyl-5-methylimidazo[4,5-b]pyridin-2-yl)-2-(2,3,3-trifluoro-2-methylcyclobutyl)acetamide
CID 160750801
5-[4-[1,1,1,3,3,3-Hexafluoro-2-(4-pyrido[4,3-b]indol-5-ylphenyl)propan-2-yl]phenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-(8-pyrido[3,2-b]indol-5-yldibenzofuran-2-yl)pyrido[3,2-b]indole;5-[4-[(4-pyrido[3,2-b]indol-5-ylphenyl)methyl]phenyl]pyrido[3,2-b]indole;9-[4-[(4-pyrido[3,4-b]indol-9-ylphenyl)methyl]phenyl]pyrido[3,4-b]indole;5-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]pyrido[3,2-b]indole;9-[4-(4-pyrido[2,3-b]indol-9-ylphenyl)phenyl]pyrido[2,3-b]indole;9-[4-(4-pyrido[3,4-b]indol-9-ylphenyl)phenyl]pyrido[3,4-b]indole;bis(8-[4-[4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)phenyl]phenyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene)
CID 160828696

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole?
The IUPAC name of 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole (CID 160590151) is 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole.
What is the SMILES notation for 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole?
The canonical SMILES for 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole is CC(C)(C)c1c(C(F)(F)F)nc2ccccn12.CC(C)(C)c1c(C2CC2)nc2ccccn12.CC(C)(C)c1c(C2CCC2)nc2ccccn12.CC(C)(C)n1c(C(F)(F)F)cc2ccccc21.CC(C)(C)n1c(C(F)(F)F)nc2ncccc21.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1[nH]c2ccccc2c1C(C)(C)C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C(C)(C)C)c2ccccc2n1C.Cc1c(C)n(C(C)(C)C)c2ccccc12.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cc2ccccc2n1C(C)(C)C.Cc1cn(C(C)(C)C)c2ccccc12.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ccccn2c1C(C)(C)C.Cc1nc2ncccc2n1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C.Cc1oc2ccccc2c1C(C)(C)C.
What is the InChIKey of 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole?
The InChIKey is RCXFHFFTHPDLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2.C14H18N2.3C14H19N.C13H14F3N.6C13H17N.2C13H16O.C12H13F3N2.3C12H16N2.C11H12F3N3.C11H15N3/c1-15(2,3)14-13(11-7-6-8-11)16-12-9-4-5-10-17(12)14;1-14(2,3)13-12(10-7-8-10)15-11-6-4-5-9-16(11)13;2*1-10-13(14(2,3)4)11-8-6-7-9-12(11)15(10)5;1-10-11(2)15(14(3,4)5)13-9-7-6-8-12(10)13;1-12(2,3)17-10-7-5-4-6-9(10)8-11(17)13(14,15)16;1-10-9-14(13(2,3)4)12-8-6-5-7-11(10)12;3*1-10-9-11-7-5-6-8-12(11)14(10)13(2,3)4;4*1-9-12(13(2,3)4)10-7-5-6-8-11(10)14-9;1-11(2,3)10-9(12(13,14)15)16-8-6-4-5-7-17(8)10;3*1-9-11(12(2,3)4)14-8-6-5-7-10(14)13-9;1-10(2,3)17-7-5-4-6-15-8(7)16-9(17)11(12,13)14;1-8-13-10-9(6-5-7-12-10)14(8)11(2,3)4/h4-5,9-11H,6-8H2,1-3H3;4-6,9-10H,7-8H2,1-3H3;3*6-9H,1-5H3;4-8H,1-3H3;4*5-9H,1-4H3;2*5-8,14H,1-4H3;2*5-8H,1-4H3;4-7H,1-3H3;3*5-8H,1-4H3;4-6H,1-3H3;5-7H,1-4H3.
What are the key properties of 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole?
3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole has a molecular weight of 4027.66 g/mol, XLogP of 72.02, 2 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-2-cyclobutylimidazo[1,2-a]pyridine;3-tert-butyl-2-cyclopropylimidazo[1,2-a]pyridine;1-tert-butyl-2,3-dimethylindole;bis(3-tert-butyl-1,2-dimethylindole);bis(3-tert-butyl-2-methyl-1-benzofuran);tris(3-tert-butyl-2-methylimidazo[1,2-a]pyridine);1-tert-butyl-2-methylimidazo[4,5-b]pyridine;tris(1-tert-butyl-2-methylindole);1-tert-butyl-3-methylindole;bis(3-tert-butyl-2-methyl-1H-indole);3-tert-butyl-2-(trifluoromethyl)imidazo[1,2-a]pyridine;1-tert-butyl-2-(trifluoromethyl)imidazo[4,5-b]pyridine;1-tert-butyl-2-(trifluoromethyl)indole is sourced from PubChem (CID 160590151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).