ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate

C301H310F9N19O51 — CID 167574648

IUPACethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
SMILESC=CCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(=O)N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC3CCCCO3)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OCC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(Oc2ccccc2)n1.CCCCCCCCOc1ccc(-c2cccc(C(=O)OCC)n2)cc1.CCCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cccc(-c2ccc(-c3cccc4ccccc34)cc2)n1.CCOC(=O)c1cccc(-c2ccc(-c3ccccn3)cc2)n1.CCOC(=O)c1cccc(-c2ccc(C(C)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccc(CC(=O)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccccc2)n1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(Oc2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1
InChIInChI=1S/C24H19NO2.C22H29NO3.C20H23NO4.C19H16N2O2.C18H20N2O3.C18H21NO4.C18H21NO2.C17H16F3NO3.C17H19NO4.C17H17NO4.C17H19NO3.C17H17NO3.C16H14F3NO3.C16H14F3NO2.C16H17NO4.C15H15NO3.C14H13NO2/c1-2-27-24(26)23-12-6-11-22(25-23)19-15-13-18(14-16-19)21-10-5-8-17-7-3-4-9-20(17)21;1-3-5-6-7-8-9-17-26-19-15-13-18(14-16-19)20-11-10-12-21(23-20)22(24)25-4-2;1-14(2)24-20(22)18-7-5-6-17(21-18)15-9-11-16(12-10-15)25-19-8-3-4-13-23-19;1-2-23-19(22)18-8-5-7-17(21-18)15-11-9-14(10-12-15)16-6-3-4-13-20-16;1-12(2)23-18(22)16-7-5-6-15(19-16)13-8-10-14(11-9-13)17(21)20(3)4;1-5-22-14-8-6-13(7-9-14)16-10-15(21-4)11-17(19-16)18(20)23-12(2)3;1-4-6-14-9-11-15(12-10-14)16-7-5-8-17(19-16)18(20)21-13(2)3;1-11(2)24-16(22)15-5-3-4-14(21-15)12-6-8-13(9-7-12)23-10-17(18,19)20;1-4-20-13-8-10-14(11-9-13)22-16-7-5-6-15(18-16)17(19)21-12(2)3;1-3-22-17(20)15-6-4-5-14(18-15)13-9-7-12(8-10-13)11-16(19)21-2;1-4-21-17(19)16-7-5-6-15(18-16)14-10-8-13(9-11-14)12(2)20-3;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)23-16(17,18)19;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)16(17,18)19;1-19-10-11-4-6-12(7-5-11)14-8-13(20-2)9-15(17-14)16(18)21-3;1-11(2)18-15(17)13-9-6-10-14(16-13)19-12-7-4-3-5-8-12;1-2-17-14(16)13-10-6-9-12(15-13)11-7-4-3-5-8-11/h3-16H,2H2,1H3;10-16H,3-9,17H2,1-2H3;5-7,9-12,14,19H,3-4,8,13H2,1-2H3;3-13H,2H2,1H3;5-12H,1-4H3;6-12H,5H2,1-4H3;5,7-13H,4,6H2,1-3H3;3-9,11H,10H2,1-2H3;5-12H,4H2,1-3H3;4-10H,3,11H2,1-2H3;5-12H,4H2,1-3H3;3,5-11H,1,4,12H2,2H3;3-10H,1-2H3;3-10H,1-2H3;4-9H,10H2,1-3H3;3-11H,1-2H3;3-10H,2H2,1H3
InChIKeyGIZHUWHSODNOEB-UHFFFAOYSA-N
MW5180.86 g/mol
LogP66.08
Rot. Bonds85

About ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate

ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate (PubChem CID 167574648) has the molecular formula C301H310F9N19O51 and a molecular weight of 5180.86 g/mol. Its IUPAC name is ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
PubChem CID167574648
Molecular FormulaC301H310F9N19O51
Molecular Weight5180.86 g/mol
Exact Mass5177.21
IUPAC Nameethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate
SMILESC=CCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(=O)N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC3CCCCO3)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OCC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(Oc2ccccc2)n1.CCCCCCCCOc1ccc(-c2cccc(C(=O)OCC)n2)cc1.CCCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cccc(-c2ccc(-c3cccc4ccccc34)cc2)n1.CCOC(=O)c1cccc(-c2ccc(-c3ccccn3)cc2)n1.CCOC(=O)c1cccc(-c2ccc(C(C)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccc(CC(=O)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccccc2)n1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(Oc2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1
InChIInChI=1S/C24H19NO2.C22H29NO3.C20H23NO4.C19H16N2O2.C18H20N2O3.C18H21NO4.C18H21NO2.C17H16F3NO3.C17H19NO4.C17H17NO4.C17H19NO3.C17H17NO3.C16H14F3NO3.C16H14F3NO2.C16H17NO4.C15H15NO3.C14H13NO2/c1-2-27-24(26)23-12-6-11-22(25-23)19-15-13-18(14-16-19)21-10-5-8-17-7-3-4-9-20(17)21;1-3-5-6-7-8-9-17-26-19-15-13-18(14-16-19)20-11-10-12-21(23-20)22(24)25-4-2;1-14(2)24-20(22)18-7-5-6-17(21-18)15-9-11-16(12-10-15)25-19-8-3-4-13-23-19;1-2-23-19(22)18-8-5-7-17(21-18)15-11-9-14(10-12-15)16-6-3-4-13-20-16;1-12(2)23-18(22)16-7-5-6-15(19-16)13-8-10-14(11-9-13)17(21)20(3)4;1-5-22-14-8-6-13(7-9-14)16-10-15(21-4)11-17(19-16)18(20)23-12(2)3;1-4-6-14-9-11-15(12-10-14)16-7-5-8-17(19-16)18(20)21-13(2)3;1-11(2)24-16(22)15-5-3-4-14(21-15)12-6-8-13(9-7-12)23-10-17(18,19)20;1-4-20-13-8-10-14(11-9-13)22-16-7-5-6-15(18-16)17(19)21-12(2)3;1-3-22-17(20)15-6-4-5-14(18-15)13-9-7-12(8-10-13)11-16(19)21-2;1-4-21-17(19)16-7-5-6-15(18-16)14-10-8-13(9-11-14)12(2)20-3;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)23-16(17,18)19;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)16(17,18)19;1-19-10-11-4-6-12(7-5-11)14-8-13(20-2)9-15(17-14)16(18)21-3;1-11(2)18-15(17)13-9-6-10-14(16-13)19-12-7-4-3-5-8-12;1-2-17-14(16)13-10-6-9-12(15-13)11-7-4-3-5-8-11/h3-16H,2H2,1H3;10-16H,3-9,17H2,1-2H3;5-7,9-12,14,19H,3-4,8,13H2,1-2H3;3-13H,2H2,1H3;5-12H,1-4H3;6-12H,5H2,1-4H3;5,7-13H,4,6H2,1-3H3;3-9,11H,10H2,1-2H3;5-12H,4H2,1-3H3;4-10H,3,11H2,1-2H3;5-12H,4H2,1-3H3;3,5-11H,1,4,12H2,2H3;3-10H,1-2H3;3-10H,1-2H3;4-9H,10H2,1-3H3;3-11H,1-2H3;3-10H,2H2,1H3
InChIKeyGIZHUWHSODNOEB-UHFFFAOYSA-N
XLogP66.08
TPSA854.95 Ų
H-Bond Donors
H-Bond Acceptors69
Rotatable Bonds85
Heavy Atoms380
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005180.86
LogP ≤ 566.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1069

Analyze ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The IUPAC name of ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate (CID 167574648) is ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate.
What is the SMILES notation for ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The canonical SMILES for ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate is C=CCOC(=O)c1cccc(-c2ccc(OCC)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(=O)N(C)C)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(C(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OC3CCCCO3)cc2)n1.CC(C)OC(=O)c1cccc(-c2ccc(OCC(F)(F)F)cc2)n1.CC(C)OC(=O)c1cccc(Oc2ccccc2)n1.CCCCCCCCOc1ccc(-c2cccc(C(=O)OCC)n2)cc1.CCCc1ccc(-c2cccc(C(=O)OC(C)C)n2)cc1.CCOC(=O)c1cccc(-c2ccc(-c3cccc4ccccc34)cc2)n1.CCOC(=O)c1cccc(-c2ccc(-c3ccccn3)cc2)n1.CCOC(=O)c1cccc(-c2ccc(C(C)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccc(CC(=O)OC)cc2)n1.CCOC(=O)c1cccc(-c2ccccc2)n1.CCOc1ccc(-c2cc(OC)cc(C(=O)OC(C)C)n2)cc1.CCOc1ccc(Oc2cccc(C(=O)OC(C)C)n2)cc1.COCc1ccc(-c2cc(OC)cc(C(=O)OC)n2)cc1.
What is the InChIKey of ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
The InChIKey is GIZHUWHSODNOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2.C22H29NO3.C20H23NO4.C19H16N2O2.C18H20N2O3.C18H21NO4.C18H21NO2.C17H16F3NO3.C17H19NO4.C17H17NO4.C17H19NO3.C17H17NO3.C16H14F3NO3.C16H14F3NO2.C16H17NO4.C15H15NO3.C14H13NO2/c1-2-27-24(26)23-12-6-11-22(25-23)19-15-13-18(14-16-19)21-10-5-8-17-7-3-4-9-20(17)21;1-3-5-6-7-8-9-17-26-19-15-13-18(14-16-19)20-11-10-12-21(23-20)22(24)25-4-2;1-14(2)24-20(22)18-7-5-6-17(21-18)15-9-11-16(12-10-15)25-19-8-3-4-13-23-19;1-2-23-19(22)18-8-5-7-17(21-18)15-11-9-14(10-12-15)16-6-3-4-13-20-16;1-12(2)23-18(22)16-7-5-6-15(19-16)13-8-10-14(11-9-13)17(21)20(3)4;1-5-22-14-8-6-13(7-9-14)16-10-15(21-4)11-17(19-16)18(20)23-12(2)3;1-4-6-14-9-11-15(12-10-14)16-7-5-8-17(19-16)18(20)21-13(2)3;1-11(2)24-16(22)15-5-3-4-14(21-15)12-6-8-13(9-7-12)23-10-17(18,19)20;1-4-20-13-8-10-14(11-9-13)22-16-7-5-6-15(18-16)17(19)21-12(2)3;1-3-22-17(20)15-6-4-5-14(18-15)13-9-7-12(8-10-13)11-16(19)21-2;1-4-21-17(19)16-7-5-6-15(18-16)14-10-8-13(9-11-14)12(2)20-3;1-3-12-21-17(19)16-7-5-6-15(18-16)13-8-10-14(11-9-13)20-4-2;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)23-16(17,18)19;1-10(2)22-15(21)14-5-3-4-13(20-14)11-6-8-12(9-7-11)16(17,18)19;1-19-10-11-4-6-12(7-5-11)14-8-13(20-2)9-15(17-14)16(18)21-3;1-11(2)18-15(17)13-9-6-10-14(16-13)19-12-7-4-3-5-8-12;1-2-17-14(16)13-10-6-9-12(15-13)11-7-4-3-5-8-11/h3-16H,2H2,1H3;10-16H,3-9,17H2,1-2H3;5-7,9-12,14,19H,3-4,8,13H2,1-2H3;3-13H,2H2,1H3;5-12H,1-4H3;6-12H,5H2,1-4H3;5,7-13H,4,6H2,1-3H3;3-9,11H,10H2,1-2H3;5-12H,4H2,1-3H3;4-10H,3,11H2,1-2H3;5-12H,4H2,1-3H3;3,5-11H,1,4,12H2,2H3;3-10H,1-2H3;3-10H,1-2H3;4-9H,10H2,1-3H3;3-11H,1-2H3;3-10H,2H2,1H3.
What are the key properties of ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate?
ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate has a molecular weight of 5180.86 g/mol, XLogP of 66.08, 85 rotatable bonds, 0 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-[4-(1-methoxyethyl)phenyl]pyridine-2-carboxylate;ethyl 6-[4-(2-methoxy-2-oxoethyl)phenyl]pyridine-2-carboxylate;ethyl 6-(4-naphthalen-1-ylphenyl)pyridine-2-carboxylate;ethyl 6-(4-octoxyphenyl)pyridine-2-carboxylate;ethyl 6-phenylpyridine-2-carboxylate;ethyl 6-(4-pyridin-2-ylphenyl)pyridine-2-carboxylate;methyl 4-methoxy-6-[4-(methoxymethyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(dimethylcarbamoyl)phenyl]pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenoxy)pyridine-2-carboxylate;propan-2-yl 6-(4-ethoxyphenyl)-4-methoxypyridine-2-carboxylate;propan-2-yl 6-[4-(oxan-2-yloxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-phenoxypyridine-2-carboxylate;propan-2-yl 6-(4-propylphenyl)pyridine-2-carboxylate;propan-2-yl 6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate;propan-2-yl 6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;prop-2-enyl 6-(4-ethoxyphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 167574648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).