N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide

C217H260F3N45O24S — CID 158259454

IUPACN-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide
SMILESCC(NC(=O)N1CCC(c2ccncc2)C1)c1ccc(S(C)(=O)=O)cc1.CCOc1cccc(CCNC(=O)N2CCC(c3cnccn3)C2)c1.COc1ccc(CCNC(=O)N2CCC(c3ccncc3)C2)cc1OC.COc1ccc(CCNC(=O)N2CCC(c3cnccn3)C2)cc1OC.COc1cccc(CCNC(=O)N2CCC(c3ccncc3)C2)c1OC.COc1cccc(CNC(=O)N2CCC(c3ccncc3)C2)c1OC.O=C(NCCc1ccccc1)N1CCC(c2ccncc2)C1.O=C(NCCc1ccccc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccccn1)N1CCC(c2cnccn2)C1.O=C(NCCc1cccnc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccncc1)N1CCC(c2cnccn2)C1.O=C(NCc1ccccc1OC(F)(F)F)N1CCC(c2ccncc2)C1
InChIInChI=1S/2C20H25N3O3.C19H24N4O3.C19H24N4O2.C19H23N3O3S.C19H23N3O3.C18H18F3N3O2.C18H21N3O.C17H20N4O.3C16H19N5O/c1-25-18-4-3-15(13-19(18)26-2)5-11-22-20(24)23-12-8-17(14-23)16-6-9-21-10-7-16;1-25-18-5-3-4-16(19(18)26-2)8-12-22-20(24)23-13-9-17(14-23)15-6-10-21-11-7-15;1-25-17-4-3-14(11-18(17)26-2)5-7-22-19(24)23-10-6-15(13-23)16-12-20-8-9-21-16;1-2-25-17-5-3-4-15(12-17)6-8-22-19(24)23-11-7-16(14-23)18-13-20-9-10-21-18;1-14(15-3-5-18(6-4-15)26(2,24)25)21-19(23)22-12-9-17(13-22)16-7-10-20-11-8-16;1-24-17-5-3-4-15(18(17)25-2)12-21-19(23)22-11-8-16(13-22)14-6-9-20-10-7-14;19-18(20,21)26-16-4-2-1-3-14(16)11-23-17(25)24-10-7-15(12-24)13-5-8-22-9-6-13;22-18(20-12-6-15-4-2-1-3-5-15)21-13-9-17(14-21)16-7-10-19-11-8-16;22-17(20-8-6-14-4-2-1-3-5-14)21-11-7-15(13-21)16-12-18-9-10-19-16;22-16(20-7-3-13-1-5-17-6-2-13)21-10-4-14(12-21)15-11-18-8-9-19-15;22-16(20-6-3-13-2-1-5-17-10-13)21-9-4-14(12-21)15-11-18-7-8-19-15;22-16(20-7-4-14-3-1-2-6-18-14)21-10-5-13(12-21)15-11-17-8-9-19-15/h3-4,6-7,9-10,13,17H,5,8,11-12,14H2,1-2H3,(H,22,24);3-7,10-11,17H,8-9,12-14H2,1-2H3,(H,22,24);3-4,8-9,11-12,15H,5-7,10,13H2,1-2H3,(H,22,24);3-5,9-10,12-13,16H,2,6-8,11,14H2,1H3,(H,22,24);3-8,10-11,14,17H,9,12-13H2,1-2H3,(H,21,23);3-7,9-10,16H,8,11-13H2,1-2H3,(H,21,23);1-6,8-9,15H,7,10-12H2,(H,23,25);1-5,7-8,10-11,17H,6,9,12-14H2,(H,20,22);1-5,9-10,12,15H,6-8,11,13H2,(H,20,22);1-2,5-6,8-9,11,14H,3-4,7,10,12H2,(H,20,22);1-2,5,7-8,10-11,14H,3-4,6,9,12H2,(H,20,22);1-3,6,8-9,11,13H,4-5,7,10,12H2,(H,20,22)
InChIKeyGHRWEKJJBWFVOJ-UHFFFAOYSA-N
MW3971.82 g/mol
LogP29.64
Rot. Bonds57

About N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide

N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide (PubChem CID 158259454) has the molecular formula C217H260F3N45O24S and a molecular weight of 3971.82 g/mol. Its IUPAC name is N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide
PubChem CID158259454
Molecular FormulaC217H260F3N45O24S
Molecular Weight3971.82 g/mol
Exact Mass3969.02
IUPAC NameN-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide
SMILESCC(NC(=O)N1CCC(c2ccncc2)C1)c1ccc(S(C)(=O)=O)cc1.CCOc1cccc(CCNC(=O)N2CCC(c3cnccn3)C2)c1.COc1ccc(CCNC(=O)N2CCC(c3ccncc3)C2)cc1OC.COc1ccc(CCNC(=O)N2CCC(c3cnccn3)C2)cc1OC.COc1cccc(CCNC(=O)N2CCC(c3ccncc3)C2)c1OC.COc1cccc(CNC(=O)N2CCC(c3ccncc3)C2)c1OC.O=C(NCCc1ccccc1)N1CCC(c2ccncc2)C1.O=C(NCCc1ccccc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccccn1)N1CCC(c2cnccn2)C1.O=C(NCCc1cccnc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccncc1)N1CCC(c2cnccn2)C1.O=C(NCc1ccccc1OC(F)(F)F)N1CCC(c2ccncc2)C1
InChIInChI=1S/2C20H25N3O3.C19H24N4O3.C19H24N4O2.C19H23N3O3S.C19H23N3O3.C18H18F3N3O2.C18H21N3O.C17H20N4O.3C16H19N5O/c1-25-18-4-3-15(13-19(18)26-2)5-11-22-20(24)23-12-8-17(14-23)16-6-9-21-10-7-16;1-25-18-5-3-4-16(19(18)26-2)8-12-22-20(24)23-13-9-17(14-23)15-6-10-21-11-7-15;1-25-17-4-3-14(11-18(17)26-2)5-7-22-19(24)23-10-6-15(13-23)16-12-20-8-9-21-16;1-2-25-17-5-3-4-15(12-17)6-8-22-19(24)23-11-7-16(14-23)18-13-20-9-10-21-18;1-14(15-3-5-18(6-4-15)26(2,24)25)21-19(23)22-12-9-17(13-22)16-7-10-20-11-8-16;1-24-17-5-3-4-15(18(17)25-2)12-21-19(23)22-11-8-16(13-22)14-6-9-20-10-7-14;19-18(20,21)26-16-4-2-1-3-14(16)11-23-17(25)24-10-7-15(12-24)13-5-8-22-9-6-13;22-18(20-12-6-15-4-2-1-3-5-15)21-13-9-17(14-21)16-7-10-19-11-8-16;22-17(20-8-6-14-4-2-1-3-5-14)21-11-7-15(13-21)16-12-18-9-10-19-16;22-16(20-7-3-13-1-5-17-6-2-13)21-10-4-14(12-21)15-11-18-8-9-19-15;22-16(20-6-3-13-2-1-5-17-10-13)21-9-4-14(12-21)15-11-18-7-8-19-15;22-16(20-7-4-14-3-1-2-6-18-14)21-10-5-13(12-21)15-11-17-8-9-19-15/h3-4,6-7,9-10,13,17H,5,8,11-12,14H2,1-2H3,(H,22,24);3-7,10-11,17H,8-9,12-14H2,1-2H3,(H,22,24);3-4,8-9,11-12,15H,5-7,10,13H2,1-2H3,(H,22,24);3-5,9-10,12-13,16H,2,6-8,11,14H2,1H3,(H,22,24);3-8,10-11,14,17H,9,12-13H2,1-2H3,(H,21,23);3-7,9-10,16H,8,11-13H2,1-2H3,(H,21,23);1-6,8-9,15H,7,10-12H2,(H,23,25);1-5,7-8,10-11,17H,6,9,12-14H2,(H,20,22);1-5,9-10,12,15H,6-8,11,13H2,(H,20,22);1-2,5-6,8-9,11,14H,3-4,7,10,12H2,(H,20,22);1-2,5,7-8,10-11,14H,3-4,6,9,12H2,(H,20,22);1-3,6,8-9,11,13H,4-5,7,10,12H2,(H,20,22)
InChIKeyGHRWEKJJBWFVOJ-UHFFFAOYSA-N
XLogP29.64
TPSA785.21 Ų
H-Bond Donors12
H-Bond Acceptors45
Rotatable Bonds57
Heavy Atoms290
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003971.82
LogP ≤ 529.64
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1045

Analyze N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide (CID 158259454) is N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide is CC(NC(=O)N1CCC(c2ccncc2)C1)c1ccc(S(C)(=O)=O)cc1.CCOc1cccc(CCNC(=O)N2CCC(c3cnccn3)C2)c1.COc1ccc(CCNC(=O)N2CCC(c3ccncc3)C2)cc1OC.COc1ccc(CCNC(=O)N2CCC(c3cnccn3)C2)cc1OC.COc1cccc(CCNC(=O)N2CCC(c3ccncc3)C2)c1OC.COc1cccc(CNC(=O)N2CCC(c3ccncc3)C2)c1OC.O=C(NCCc1ccccc1)N1CCC(c2ccncc2)C1.O=C(NCCc1ccccc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccccn1)N1CCC(c2cnccn2)C1.O=C(NCCc1cccnc1)N1CCC(c2cnccn2)C1.O=C(NCCc1ccncc1)N1CCC(c2cnccn2)C1.O=C(NCc1ccccc1OC(F)(F)F)N1CCC(c2ccncc2)C1.
What is the InChIKey of N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide?
The InChIKey is GHRWEKJJBWFVOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H25N3O3.C19H24N4O3.C19H24N4O2.C19H23N3O3S.C19H23N3O3.C18H18F3N3O2.C18H21N3O.C17H20N4O.3C16H19N5O/c1-25-18-4-3-15(13-19(18)26-2)5-11-22-20(24)23-12-8-17(14-23)16-6-9-21-10-7-16;1-25-18-5-3-4-16(19(18)26-2)8-12-22-20(24)23-13-9-17(14-23)15-6-10-21-11-7-15;1-25-17-4-3-14(11-18(17)26-2)5-7-22-19(24)23-10-6-15(13-23)16-12-20-8-9-21-16;1-2-25-17-5-3-4-15(12-17)6-8-22-19(24)23-11-7-16(14-23)18-13-20-9-10-21-18;1-14(15-3-5-18(6-4-15)26(2,24)25)21-19(23)22-12-9-17(13-22)16-7-10-20-11-8-16;1-24-17-5-3-4-15(18(17)25-2)12-21-19(23)22-11-8-16(13-22)14-6-9-20-10-7-14;19-18(20,21)26-16-4-2-1-3-14(16)11-23-17(25)24-10-7-15(12-24)13-5-8-22-9-6-13;22-18(20-12-6-15-4-2-1-3-5-15)21-13-9-17(14-21)16-7-10-19-11-8-16;22-17(20-8-6-14-4-2-1-3-5-14)21-11-7-15(13-21)16-12-18-9-10-19-16;22-16(20-7-3-13-1-5-17-6-2-13)21-10-4-14(12-21)15-11-18-8-9-19-15;22-16(20-6-3-13-2-1-5-17-10-13)21-9-4-14(12-21)15-11-18-7-8-19-15;22-16(20-7-4-14-3-1-2-6-18-14)21-10-5-13(12-21)15-11-17-8-9-19-15/h3-4,6-7,9-10,13,17H,5,8,11-12,14H2,1-2H3,(H,22,24);3-7,10-11,17H,8-9,12-14H2,1-2H3,(H,22,24);3-4,8-9,11-12,15H,5-7,10,13H2,1-2H3,(H,22,24);3-5,9-10,12-13,16H,2,6-8,11,14H2,1H3,(H,22,24);3-8,10-11,14,17H,9,12-13H2,1-2H3,(H,21,23);3-7,9-10,16H,8,11-13H2,1-2H3,(H,21,23);1-6,8-9,15H,7,10-12H2,(H,23,25);1-5,7-8,10-11,17H,6,9,12-14H2,(H,20,22);1-5,9-10,12,15H,6-8,11,13H2,(H,20,22);1-2,5-6,8-9,11,14H,3-4,7,10,12H2,(H,20,22);1-2,5,7-8,10-11,14H,3-4,6,9,12H2,(H,20,22);1-3,6,8-9,11,13H,4-5,7,10,12H2,(H,20,22).
What are the key properties of N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide?
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide has a molecular weight of 3971.82 g/mol, XLogP of 29.64, 57 rotatable bonds, 12 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[2-(2,3-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[(2,3-dimethoxyphenyl)methyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-[2-(3-ethoxyphenyl)ethyl]-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-[1-(4-methylsulfonylphenyl)ethyl]-3-pyridin-4-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyrazin-2-ylpyrrolidine-1-carboxamide;N-(2-phenylethyl)-3-pyridin-4-ylpyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-2-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide;3-pyrazin-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-1-carboxamide;3-pyridin-4-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 158259454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).