2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline

C160H220N16O10 — CID 162088720

IUPAC2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline
SMILESCC(C)c1cc(-c2ccccc2)nn1C.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1ccc(N2CCCC2)cn1.CC(C)c1ccc(N2CCCCC2)nc1.CC(C)c1ccc2ncccc2c1.CCOc1ncccc1C(C)C.COc1ccc(C(C)C)c(OC)n1.COc1cccc(C(C)C)n1.COc1nc(C(C)C)ccc1OC(C)C.Cc1cc(C(C)C)cnc1OC(C)C.Cc1ccc(-c2cc(C(C)C)no2)cc1.Cc1ccc(C(C)C)nc1.Cc1nc(C(C)C)ccc1OC(C)C
InChIInChI=1S/C13H16N2.C13H20N2.C13H15NO.C12H18N2.C12H19NO2.2C12H19NO.2C12H13N.C11H12O.C10H15NO2.C10H15NO.C9H13NO.C9H13N/c1-10(2)13-9-12(14-15(13)3)11-7-5-4-6-8-11;1-11(2)12-6-7-13(14-10-12)15-8-4-3-5-9-15;1-9(2)12-8-13(15-14-12)11-6-4-10(3)5-7-11;1-10(2)12-6-5-11(9-13-12)14-7-3-4-8-14;1-8(2)10-6-7-11(15-9(3)4)12(13-10)14-5;1-8(2)11-6-10(5)12(13-7-11)14-9(3)4;1-8(2)11-6-7-12(10(5)13-11)14-9(3)4;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-7(2)8-5-6-9(12-3)11-10(8)13-4;1-4-12-10-9(8(2)3)6-5-7-11-10;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)6-10-9/h4-10H,1-3H3;6-7,10-11H,3-5,8-9H2,1-2H3;4-9H,1-3H3;5-6,9-10H,3-4,7-8H2,1-2H3;6-9H,1-5H3;2*6-9H,1-5H3;2*3-9H,1-2H3;3-8H,1-2H3;5-7H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3;4-7H,1-3H3
InChIKeyZDHSCGZRHARLSA-UHFFFAOYSA-N
MW2527.62 g/mol
LogP42.41
Rot. Bonds30

About 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline

2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline (PubChem CID 162088720) has the molecular formula C160H220N16O10 and a molecular weight of 2527.62 g/mol. Its IUPAC name is 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline.

Molecular Properties

Compound Name2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline
PubChem CID162088720
Molecular FormulaC160H220N16O10
Molecular Weight2527.62 g/mol
Exact Mass2525.72
IUPAC Name2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline
SMILESCC(C)c1cc(-c2ccccc2)nn1C.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1ccc(N2CCCC2)cn1.CC(C)c1ccc(N2CCCCC2)nc1.CC(C)c1ccc2ncccc2c1.CCOc1ncccc1C(C)C.COc1ccc(C(C)C)c(OC)n1.COc1cccc(C(C)C)n1.COc1nc(C(C)C)ccc1OC(C)C.Cc1cc(C(C)C)cnc1OC(C)C.Cc1ccc(-c2cc(C(C)C)no2)cc1.Cc1ccc(C(C)C)nc1.Cc1nc(C(C)C)ccc1OC(C)C
InChIInChI=1S/C13H16N2.C13H20N2.C13H15NO.C12H18N2.C12H19NO2.2C12H19NO.2C12H13N.C11H12O.C10H15NO2.C10H15NO.C9H13NO.C9H13N/c1-10(2)13-9-12(14-15(13)3)11-7-5-4-6-8-11;1-11(2)12-6-7-13(14-10-12)15-8-4-3-5-9-15;1-9(2)12-8-13(15-14-12)11-6-4-10(3)5-7-11;1-10(2)12-6-5-11(9-13-12)14-7-3-4-8-14;1-8(2)10-6-7-11(15-9(3)4)12(13-10)14-5;1-8(2)11-6-10(5)12(13-7-11)14-9(3)4;1-8(2)11-6-7-12(10(5)13-11)14-9(3)4;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-7(2)8-5-6-9(12-3)11-10(8)13-4;1-4-12-10-9(8(2)3)6-5-7-11-10;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)6-10-9/h4-10H,1-3H3;6-7,10-11H,3-5,8-9H2,1-2H3;4-9H,1-3H3;5-6,9-10H,3-4,7-8H2,1-2H3;6-9H,1-5H3;2*6-9H,1-5H3;2*3-9H,1-2H3;3-8H,1-2H3;5-7H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3;4-7H,1-3H3
InChIKeyZDHSCGZRHARLSA-UHFFFAOYSA-N
XLogP42.41
TPSA279.10 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds30
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002527.62
LogP ≤ 542.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Analyze 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline with MolForge

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Related Compounds

3-[7-[2-(6,7-dimethylcinnolin-3-yl)ethynyl]-4-methylfuro[2,3-c]pyridin-3-yl]oxy-N,N-dimethylaniline;7-[2-(2,5-dimethylquinazolin-7-yl)ethynyl]-6-methoxy-3-[3-methyl-5-(piperidin-1-ylmethyl)phenoxy]-[1,2]oxazolo[4,5-c]pyridine;7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-3-[[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole
CID 158380271
3-[(E)-2-[3-(1,2-benzoxazol-6-yl)-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;3-[(E)-2-[3-[5-(ethenylamino)pyrazin-2-yl]-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;3-[(E)-2-[3-[6-(ethenylamino)-3-pyridinyl]-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;6-[3-[(E)-2-(5-ethenyl-2-methylphenyl)ethenyl]-2-methylphenyl]-2-methyl-1,3-benzoxazole;methane;4-methyl-3-[(E)-2-[2-methyl-3-(2-methylindazol-6-yl)phenyl]ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyrazin-2-ylphenyl)ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyridin-2-ylphenyl)ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyridin-3-ylphenyl)ethenyl]benzaldehyde
CID 167630019
3-[(E)-2-[3-(1,2-benzoxazol-6-yl)-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;3-[(E)-2-[3-[5-(ethenylamino)pyrazin-2-yl]-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;3-[(E)-2-[3-[6-(ethenylamino)-3-pyridinyl]-2-methylphenyl]ethenyl]-4-(trifluoromethyl)benzaldehyde;6-[3-[(E)-2-(5-ethenyl-2-methylphenyl)ethenyl]-2-methylphenyl]-2-methyl-1,3-benzoxazole;4-methyl-3-[(E)-2-[2-methyl-3-(2-methylindazol-6-yl)phenyl]ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyrazin-2-ylphenyl)ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyridin-2-ylphenyl)ethenyl]benzaldehyde;4-methyl-3-[(E)-2-(2-methyl-3-pyridin-3-ylphenyl)ethenyl]benzaldehyde
CID 167693179
10-[9-[8-[3,6-Bis(2-pyridin-2-ylphenyl)carbazol-9-yl]-5a,9a-dihydrodibenzofuran-4-yl]carbazol-3-yl]-4-(3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-8-oxa-3,13-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaene
CID 88985962
CID 157375551
CID 157375551
3,21-Dimethyl-14-aza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;1,12-dimethylimidazo[1,2-f]phenanthridin-1-ium;ethane;21-methyl-6,14-diaza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;1-methyl-2-(2-methylphenyl)-3-phenylbenzimidazol-1-ium;1-methyl-2-(2-methylphenyl)-3-phenylimidazol-1-ium;2-methyl-1-(2-methylphenyl)pyrazol-2-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 157500281
8-tert-butyl-3,4-dihydro-2H-chromene;7-tert-butyl-4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;7-tert-butyl-1-methyl-3,4-dihydroquinolin-2-one;3-tert-butyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;6-tert-butyl-1-propylquinolin-4-one;3-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;3-tert-butyl-2,6,6-trimethyl-4,7-dihydropyrazolo[5,1-c][1,4]oxazine;2,2-dimethylpropane;methane;6-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine
CID 157547568
8-tert-butyl-3,4-dihydro-2H-chromene;2-tert-butyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;3-tert-butyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;3-tert-butyl-6-methyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;7-tert-butyl-4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine;7-tert-butyl-1-methyl-3,4-dihydroquinolin-2-one;3-tert-butyl-5-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;6-tert-butyl-1-propylquinolin-4-one;3-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;3-tert-butyl-2,6,6-trimethyl-4,7-dihydropyrazolo[5,1-c][1,4]oxazine
CID 157599680
3,21-Dimethyl-14-aza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;3,21-dimethyl-6,14-diaza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;1,12-dimethylimidazo[1,2-f]phenanthridin-1-ium;ethane;1-methyl-2-(2-methylphenyl)-3-phenylbenzimidazol-1-ium;1-methyl-2-(2-methylphenyl)-3-phenylimidazol-1-ium;3-methyl-4-(2-methylphenyl)-1-phenylimidazol-3-ium;2-methyl-1-(2-methylphenyl)pyrazol-2-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 157650252
bis(3,21-dimethyl-14-aza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene);1,12-dimethylimidazo[1,2-f]phenanthridin-1-ium;(2S)-1,2-dimethyl-3-(2-methylphenyl)-2H-benzimidazole;(2S)-1,2-dimethyl-3-(2-methylphenyl)-2H-imidazole;1,11-dimethylpyrazolo[1,5-f]phenanthridin-1-ium;ethane;1-methyl-2-(2-methylphenyl)-3-phenylbenzimidazol-1-ium;1-methyl-2-(2-methylphenyl)-3-phenylimidazol-1-ium;2-methyl-1-(2-methylphenyl)pyrazol-2-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 157700194
3,21-dimethyl-14-aza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;3,21-dimethyl-6,14-diaza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;1,12-dimethylimidazo[1,2-f]phenanthridin-1-ium;(2S)-1,2-dimethyl-3-(2-methylphenyl)-2H-benzimidazole;(2S)-1,2-dimethyl-3-(2-methylphenyl)-2H-imidazole;1,11-dimethylpyrazolo[1,5-f]phenanthridin-1-ium;ethane;methane;1-methyl-2-(2-methylphenyl)-3-phenylbenzimidazol-1-ium;1-methyl-2-(2-methylphenyl)-3-phenylimidazol-1-ium;2-methyl-1-(2-methylphenyl)pyrazol-2-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 157719848
3,21-Dimethyl-14-aza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;3,21-dimethyl-6,14-diaza-21-azoniapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene;1,12-dimethylimidazo[1,2-f]phenanthridin-1-ium;ethane;1-methyl-2-(2-methylphenyl)-3-phenylbenzimidazol-1-ium;1-methyl-2-(2-methylphenyl)-3-phenylimidazol-1-ium;2-methyl-1-(2-methylphenyl)pyrazol-2-ium;7-methyl-6-(1-methylpyridin-1-ium-2-yl)-[1]benzofuro[3,2-b]pyridine
CID 157787195

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline?
The IUPAC name of 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline (CID 162088720) is 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline.
What is the SMILES notation for 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline?
The canonical SMILES for 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline is CC(C)c1cc(-c2ccccc2)nn1C.CC(C)c1cc2ccccc2cn1.CC(C)c1cc2ccccc2o1.CC(C)c1ccc(N2CCCC2)cn1.CC(C)c1ccc(N2CCCCC2)nc1.CC(C)c1ccc2ncccc2c1.CCOc1ncccc1C(C)C.COc1ccc(C(C)C)c(OC)n1.COc1cccc(C(C)C)n1.COc1nc(C(C)C)ccc1OC(C)C.Cc1cc(C(C)C)cnc1OC(C)C.Cc1ccc(-c2cc(C(C)C)no2)cc1.Cc1ccc(C(C)C)nc1.Cc1nc(C(C)C)ccc1OC(C)C.
What is the InChIKey of 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline?
The InChIKey is ZDHSCGZRHARLSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2.C13H20N2.C13H15NO.C12H18N2.C12H19NO2.2C12H19NO.2C12H13N.C11H12O.C10H15NO2.C10H15NO.C9H13NO.C9H13N/c1-10(2)13-9-12(14-15(13)3)11-7-5-4-6-8-11;1-11(2)12-6-7-13(14-10-12)15-8-4-3-5-9-15;1-9(2)12-8-13(15-14-12)11-6-4-10(3)5-7-11;1-10(2)12-6-5-11(9-13-12)14-7-3-4-8-14;1-8(2)10-6-7-11(15-9(3)4)12(13-10)14-5;1-8(2)11-6-10(5)12(13-7-11)14-9(3)4;1-8(2)11-6-7-12(10(5)13-11)14-9(3)4;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)12-7-10-5-3-4-6-11(10)8-13-12;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-7(2)8-5-6-9(12-3)11-10(8)13-4;1-4-12-10-9(8(2)3)6-5-7-11-10;1-7(2)8-5-4-6-9(10-8)11-3;1-7(2)9-5-4-8(3)6-10-9/h4-10H,1-3H3;6-7,10-11H,3-5,8-9H2,1-2H3;4-9H,1-3H3;5-6,9-10H,3-4,7-8H2,1-2H3;6-9H,1-5H3;2*6-9H,1-5H3;2*3-9H,1-2H3;3-8H,1-2H3;5-7H,1-4H3;5-8H,4H2,1-3H3;4-7H,1-3H3;4-7H,1-3H3.
What are the key properties of 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline?
2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline has a molecular weight of 2527.62 g/mol, XLogP of 42.41, 30 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-3-propan-2-ylpyridine;2-ethoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-yl-3-propan-2-yloxypyridine;2-methoxy-6-propan-2-ylpyridine;5-(4-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;2-methyl-6-propan-2-yl-3-propan-2-yloxypyridine;3-methyl-5-propan-2-yl-2-propan-2-yloxypyridine;5-methyl-2-propan-2-ylpyridine;2-piperidin-1-yl-5-propan-2-ylpyridine;2-propan-2-yl-1-benzofuran;3-propan-2-ylisoquinoline;2-propan-2-yl-5-pyrrolidin-1-ylpyridine;6-propan-2-ylquinoline is sourced from PubChem (CID 162088720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).