benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate

C315H346FN19O58S — CID 167635398

IUPACbenzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
SMILESCC(=O)Oc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CC(C)OC(=O)c1cccc(-c2ccc(F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccccc2)n1.CCCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cc(C)cc(-c2ccc(OCC)cc2)n1.CCOC(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)(C)C)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)CC)n2)cc1.CCS(=O)(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(C)cc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC3CC3)n2)cc1.COCc1ccc(-c2cccc(C(=O)OCc3ccccc3)n2)cc1
InChIInChI=1S/C21H19NO3.C20H25NO5.C19H23NO4.C18H19NO4.4C18H21NO3.C17H20N2O2.C17H19NO4S.C17H17NO4.C17H17NO3.3C17H19NO3.C16H17NO4.C15H14FNO2.C15H15NO2/c1-24-14-17-10-12-18(13-11-17)19-8-5-9-20(22-19)21(23)25-15-16-6-3-2-4-7-16;1-15(2)26-20(22)19-6-4-5-18(21-19)16-7-9-17(10-8-16)25-14-13-24-12-11-23-3;1-4-22-12-13-23-16-10-8-15(9-11-16)17-6-5-7-18(20-17)19(21)24-14(2)3;1-4-22-17(20)14-10-8-13(9-11-14)15-6-5-7-16(19-15)18(21)23-12(2)3;1-12(2)22-18(20)17-10-13(3)9-16(19-17)15-7-5-14(6-8-15)11-21-4;1-5-21-14-11-9-13(10-12-14)15-7-6-8-16(19-15)17(20)22-18(2,3)4;1-4-12-21-15-10-8-14(9-11-15)16-6-5-7-17(19-16)18(20)22-13(2)3;1-4-13(3)22-18(20)17-8-6-7-16(19-17)14-9-11-15(12-10-14)21-5-2;1-12(2)21-17(20)16-7-5-6-15(18-16)13-8-10-14(11-9-13)19(3)4;1-4-23(20,21)14-10-8-13(9-11-14)15-6-5-7-16(18-15)17(19)22-12(2)3;1-11(2)21-17(20)16-6-4-5-15(18-16)13-7-9-14(10-8-13)22-12(3)19;1-20-11-12-5-7-13(8-6-12)15-3-2-4-16(18-15)17(19)21-14-9-10-14;1-12(2)21-17(19)16-6-4-5-15(18-16)14-9-7-13(8-10-14)11-20-3;1-4-20-14-8-6-13(7-9-14)15-10-12(3)11-16(18-15)17(19)21-5-2;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-4-21-12-7-5-11(6-8-12)14-9-13(19-2)10-15(17-14)16(18)20-3;1-10(2)19-15(18)14-5-3-4-13(17-14)11-6-8-12(16)9-7-11;1-11(2)18-15(17)14-10-6-9-13(16-14)12-7-4-3-5-8-12/h2-13H,14-15H2,1H3;4-10,15H,11-14H2,1-3H3;5-11,14H,4,12-13H2,1-3H3;5-12H,4H2,1-3H3;5-10,12H,11H2,1-4H3;6-12H,5H2,1-4H3;5-11,13H,4,12H2,1-3H3;6-13H,4-5H2,1-3H3;5-12H,1-4H3;5-12H,4H2,1-3H3;4-11H,1-3H3;2-8,14H,9-11H2,1H3;4-10,12H,11H2,1-3H3;6-11H,4-5H2,1-3H3;5-11H,3-4,12H2,1-2H3;5-10H,4H2,1-3H3;3-10H,1-2H3;3-11H,1-2H3
InChIKeyOKCYQSCCTBWLEU-UHFFFAOYSA-N
MW5377.37 g/mol
LogP64.36
Rot. Bonds95

About benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate

benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate (PubChem CID 167635398) has the molecular formula C315H346FN19O58S and a molecular weight of 5377.37 g/mol. Its IUPAC name is benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate.

Molecular Properties

Compound Namebenzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
PubChem CID167635398
Molecular FormulaC315H346FN19O58S
Molecular Weight5377.37 g/mol
Exact Mass5373.44
IUPAC Namebenzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
SMILESCC(=O)Oc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CC(C)OC(=O)c1cccc(-c2ccc(F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccccc2)n1.CCCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cc(C)cc(-c2ccc(OCC)cc2)n1.CCOC(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)(C)C)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)CC)n2)cc1.CCS(=O)(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(C)cc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC3CC3)n2)cc1.COCc1ccc(-c2cccc(C(=O)OCc3ccccc3)n2)cc1
InChIInChI=1S/C21H19NO3.C20H25NO5.C19H23NO4.C18H19NO4.4C18H21NO3.C17H20N2O2.C17H19NO4S.C17H17NO4.C17H17NO3.3C17H19NO3.C16H17NO4.C15H14FNO2.C15H15NO2/c1-24-14-17-10-12-18(13-11-17)19-8-5-9-20(22-19)21(23)25-15-16-6-3-2-4-7-16;1-15(2)26-20(22)19-6-4-5-18(21-19)16-7-9-17(10-8-16)25-14-13-24-12-11-23-3;1-4-22-12-13-23-16-10-8-15(9-11-16)17-6-5-7-18(20-17)19(21)24-14(2)3;1-4-22-17(20)14-10-8-13(9-11-14)15-6-5-7-16(19-15)18(21)23-12(2)3;1-12(2)22-18(20)17-10-13(3)9-16(19-17)15-7-5-14(6-8-15)11-21-4;1-5-21-14-11-9-13(10-12-14)15-7-6-8-16(19-15)17(20)22-18(2,3)4;1-4-12-21-15-10-8-14(9-11-15)16-6-5-7-17(19-16)18(20)22-13(2)3;1-4-13(3)22-18(20)17-8-6-7-16(19-17)14-9-11-15(12-10-14)21-5-2;1-12(2)21-17(20)16-7-5-6-15(18-16)13-8-10-14(11-9-13)19(3)4;1-4-23(20,21)14-10-8-13(9-11-14)15-6-5-7-16(18-15)17(19)22-12(2)3;1-11(2)21-17(20)16-6-4-5-15(18-16)13-7-9-14(10-8-13)22-12(3)19;1-20-11-12-5-7-13(8-6-12)15-3-2-4-16(18-15)17(19)21-14-9-10-14;1-12(2)21-17(19)16-6-4-5-15(18-16)14-9-7-13(8-10-14)11-20-3;1-4-20-14-8-6-13(7-9-14)15-10-12(3)11-16(18-15)17(19)21-5-2;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-4-21-12-7-5-11(6-8-12)14-9-13(19-2)10-15(17-14)16(18)20-3;1-10(2)19-15(18)14-5-3-4-13(17-14)11-6-8-12(16)9-7-11;1-11(2)18-15(17)14-10-6-9-13(16-14)12-7-4-3-5-8-12/h2-13H,14-15H2,1H3;4-10,15H,11-14H2,1-3H3;5-11,14H,4,12-13H2,1-3H3;5-12H,4H2,1-3H3;5-10,12H,11H2,1-4H3;6-12H,5H2,1-4H3;5-11,13H,4,12H2,1-3H3;6-13H,4-5H2,1-3H3;5-12H,1-4H3;5-12H,4H2,1-3H3;4-11H,1-3H3;2-8,14H,9-11H2,1H3;4-10,12H,11H2,1-3H3;6-11H,4-5H2,1-3H3;5-11H,3-4,12H2,1-2H3;5-10H,4H2,1-3H3;3-10H,1-2H3;3-11H,1-2H3
InChIKeyOKCYQSCCTBWLEU-UHFFFAOYSA-N
XLogP64.36
TPSA943.08 Ų
H-Bond Donors
H-Bond Acceptors77
Rotatable Bonds95
Heavy Atoms394
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005377.37
LogP ≤ 564.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1077

Analyze benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The IUPAC name of benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate (CID 167635398) is benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate.
What is the SMILES notation for benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The canonical SMILES for benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate is CC(=O)Oc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CC(C)OC(=O)c1cccc(-c2ccc(F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccccc2)n1.CCCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cc(C)cc(-c2ccc(OCC)cc2)n1.CCOC(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)(C)C)n2)cc1.CCOc1ccc(-c2cccc(C(=O)OC(C)CC)n2)cc1.CCS(=O)(=O)c1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCCOCCOc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(C)cc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cccc(C(=O)OC3CC3)n2)cc1.COCc1ccc(-c2cccc(C(=O)OCc3ccccc3)n2)cc1.
What is the InChIKey of benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The InChIKey is OKCYQSCCTBWLEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO3.C20H25NO5.C19H23NO4.C18H19NO4.4C18H21NO3.C17H20N2O2.C17H19NO4S.C17H17NO4.C17H17NO3.3C17H19NO3.C16H17NO4.C15H14FNO2.C15H15NO2/c1-24-14-17-10-12-18(13-11-17)19-8-5-9-20(22-19)21(23)25-15-16-6-3-2-4-7-16;1-15(2)26-20(22)19-6-4-5-18(21-19)16-7-9-17(10-8-16)25-14-13-24-12-11-23-3;1-4-22-12-13-23-16-10-8-15(9-11-16)17-6-5-7-18(20-17)19(21)24-14(2)3;1-4-22-17(20)14-10-8-13(9-11-14)15-6-5-7-16(19-15)18(21)23-12(2)3;1-12(2)22-18(20)17-10-13(3)9-16(19-17)15-7-5-14(6-8-15)11-21-4;1-5-21-14-11-9-13(10-12-14)15-7-6-8-16(19-15)17(20)22-18(2,3)4;1-4-12-21-15-10-8-14(9-11-15)16-6-5-7-17(19-16)18(20)22-13(2)3;1-4-13(3)22-18(20)17-8-6-7-16(19-17)14-9-11-15(12-10-14)21-5-2;1-12(2)21-17(20)16-7-5-6-15(18-16)13-8-10-14(11-9-13)19(3)4;1-4-23(20,21)14-10-8-13(9-11-14)15-6-5-7-16(18-15)17(19)22-12(2)3;1-11(2)21-17(20)16-6-4-5-15(18-16)13-7-9-14(10-8-13)22-12(3)19;1-20-11-12-5-7-13(8-6-12)15-3-2-4-16(18-15)17(19)21-14-9-10-14;1-12(2)21-17(19)16-6-4-5-15(18-16)14-9-7-13(8-10-14)11-20-3;1-4-20-14-8-6-13(7-9-14)15-10-12(3)11-16(18-15)17(19)21-5-2;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-4-21-12-7-5-11(6-8-12)14-9-13(19-2)10-15(17-14)16(18)20-3;1-10(2)19-15(18)14-5-3-4-13(17-14)11-6-8-12(16)9-7-11;1-11(2)18-15(17)14-10-6-9-13(16-14)12-7-4-3-5-8-12/h2-13H,14-15H2,1H3;4-10,15H,11-14H2,1-3H3;5-11,14H,4,12-13H2,1-3H3;5-12H,4H2,1-3H3;5-10,12H,11H2,1-4H3;6-12H,5H2,1-4H3;5-11,13H,4,12H2,1-3H3;6-13H,4-5H2,1-3H3;5-12H,1-4H3;5-12H,4H2,1-3H3;4-11H,1-3H3;2-8,14H,9-11H2,1H3;4-10,12H,11H2,1-3H3;6-11H,4-5H2,1-3H3;5-11H,3-4,12H2,1-2H3;5-10H,4H2,1-3H3;3-10H,1-2H3;3-11H,1-2H3.
What are the key properties of benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate has a molecular weight of 5377.37 g/mol, XLogP of 64.36, 95 rotatable bonds, 0 hydrogen bond donors, and 77 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;butan-2-yl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;tert-butyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate;cyclopropyl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-ethoxyphenyl)-4-methylpyridine-2-carboxylate;methyl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-(4-acetyloxyphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylamino)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxycarbonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2-ethoxyethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethylsulfonylphenyl)pyridine-2-carboxylate;propan-2-yl 6-(4-fluorophenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-[2-(2-methoxyethoxy)ethoxy]phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]-4-methylpyridine-2-carboxylate;propan-2-yl 6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenylpyridine-2-carboxylate;propan-2-yl 6-(4-propoxyphenyl)pyridine-2-carboxylate;propyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 167635398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).