C298H477N37O44 — CID 157404733
2-butoxy-N-methylacetamide;2-hexoxy-N-methylacetamide;N-methylheptanamide;N-methylhexanamide;5-methyl-3-[4-(4-methylphenoxy)butyl]-1,2-oxazole;5-methyl-3-[2-[2-(4-methylphenoxy)ethoxy]ethyl]-1,2-oxazole;N-methyl-2-[4-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperidin-4-yl]acetamide;5-methyl-3-[2-(4-methylphenoxy)ethoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-(4-methylphenoxy)ethoxy]propyl]-1,2-oxazole;5-methyl-3-[2-(4-methylphenoxy)ethyl]-1,2-oxazole;5-methyl-3-[(4-methylphenoxy)methyl]-1,2-oxazole;5-methyl-3-[5-(4-methylphenoxy)pentyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propoxymethyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propyl]-1,2-oxazole;N-methyl-2-(4-methylphenyl)acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-1-yl]acetamide;N-methyl-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]acetamide;N-methyl-2-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]acetamide;N-methyl-2-pentoxyacetamide;N-methyl-2-propoxyacetamide (PubChem CID 157404733) has the molecular formula C298H477N37O44 and a molecular weight of 5282.31 g/mol. Its IUPAC name is 2-butoxy-N-methylacetamide;2-hexoxy-N-methylacetamide;N-methylheptanamide;N-methylhexanamide;5-methyl-3-[4-(4-methylphenoxy)butyl]-1,2-oxazole;5-methyl-3-[2-[2-(4-methylphenoxy)ethoxy]ethyl]-1,2-oxazole;N-methyl-2-[4-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperidin-4-yl]acetamide;5-methyl-3-[2-(4-methylphenoxy)ethoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-(4-methylphenoxy)ethoxy]propyl]-1,2-oxazole;5-methyl-3-[2-(4-methylphenoxy)ethyl]-1,2-oxazole;5-methyl-3-[(4-methylphenoxy)methyl]-1,2-oxazole;5-methyl-3-[5-(4-methylphenoxy)pentyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propoxymethyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propyl]-1,2-oxazole;N-methyl-2-(4-methylphenyl)acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-1-yl]acetamide;N-methyl-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]acetamide;N-methyl-2-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]acetamide;N-methyl-2-pentoxyacetamide;N-methyl-2-propoxyacetamide.
| Compound Name | 2-butoxy-N-methylacetamide;2-hexoxy-N-methylacetamide;N-methylheptanamide;N-methylhexanamide;5-methyl-3-[4-(4-methylphenoxy)butyl]-1,2-oxazole;5-methyl-3-[2-[2-(4-methylphenoxy)ethoxy]ethyl]-1,2-oxazole;N-methyl-2-[4-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperidin-4-yl]acetamide;5-methyl-3-[2-(4-methylphenoxy)ethoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-(4-methylphenoxy)ethoxy]propyl]-1,2-oxazole;5-methyl-3-[2-(4-methylphenoxy)ethyl]-1,2-oxazole;5-methyl-3-[(4-methylphenoxy)methyl]-1,2-oxazole;5-methyl-3-[5-(4-methylphenoxy)pentyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propoxymethyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propyl]-1,2-oxazole;N-methyl-2-(4-methylphenyl)acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-1-yl]acetamide;N-methyl-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]acetamide;N-methyl-2-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]acetamide;N-methyl-2-pentoxyacetamide;N-methyl-2-propoxyacetamide |
|---|---|
| PubChem CID | 157404733 |
| Molecular Formula | C298H477N37O44 |
| Molecular Weight | 5282.31 g/mol |
| Exact Mass | 5278.62 |
| IUPAC Name | 2-butoxy-N-methylacetamide;2-hexoxy-N-methylacetamide;N-methylheptanamide;N-methylhexanamide;5-methyl-3-[4-(4-methylphenoxy)butyl]-1,2-oxazole;5-methyl-3-[2-[2-(4-methylphenoxy)ethoxy]ethyl]-1,2-oxazole;N-methyl-2-[4-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-[2-(4-methylphenoxy)ethoxy]ethyl]piperidin-4-yl]acetamide;5-methyl-3-[2-(4-methylphenoxy)ethoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-(4-methylphenoxy)ethoxy]propyl]-1,2-oxazole;5-methyl-3-[2-(4-methylphenoxy)ethyl]-1,2-oxazole;5-methyl-3-[(4-methylphenoxy)methyl]-1,2-oxazole;5-methyl-3-[5-(4-methylphenoxy)pentyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propoxymethyl]-1,2-oxazole;5-methyl-3-[3-(4-methylphenoxy)propyl]-1,2-oxazole;N-methyl-2-(4-methylphenyl)acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperidin-1-yl)ethyl]piperidin-1-yl]acetamide;N-methyl-2-[4-[(4-methylpiperidin-1-yl)methyl]piperidin-1-yl]acetamide;N-methyl-2-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]acetamide;N-methyl-2-pentoxyacetamide;N-methyl-2-propoxyacetamide |
| SMILES | CCCCCC(=O)NC.CCCCCCC(=O)NC.CCCCCCOCC(=O)NC.CCCCCOCC(=O)NC.CCCCOCC(=O)NC.CCCOCC(=O)NC.CNC(=O)CC1CCN(CCN2CCC(C)CC2)CC1.CNC(=O)CC1CCN(CCOCCOc2ccc(C)cc2)CC1.CNC(=O)CN1CCC(CCN2CCC(C)CC2)CC1.CNC(=O)CN1CCC(CN2CCC(C)CC2)CC1.CNC(=O)CN1CCC(N2CCC(C)CC2)CC1.CNC(=O)CN1CCN(CCN2CCC(C)CC2)CC1.CNC(=O)CN1CCN(CCOCCOc2ccc(C)cc2)CC1.CNC(=O)Cc1ccc(C)cc1.Cc1ccc(OCCCCCc2cc(C)on2)cc1.Cc1ccc(OCCCCc2cc(C)on2)cc1.Cc1ccc(OCCCOCc2cc(C)on2)cc1.Cc1ccc(OCCCc2cc(C)on2)cc1.Cc1ccc(OCCOCCCc2cc(C)on2)cc1.Cc1ccc(OCCOCCc2cc(C)on2)cc1.Cc1ccc(OCCOCc2cc(C)on2)cc1.Cc1ccc(OCCc2cc(C)on2)cc1.Cc1ccc(OCc2cc(C)on2)cc1 |
| InChI | InChI=1S/C19H30N2O3.C18H29N3O3.2C16H31N3O.C16H21NO3.C16H21NO2.C15H30N4O.C15H29N3O.2C15H19NO3.C15H19NO2.C14H27N3O.C14H17NO3.C14H17NO2.C13H15NO2.C12H13NO2.C10H13NO.C9H19NO2.C8H17NO2.C8H17NO.C7H15NO2.C7H15NO.C6H13NO2/c1-16-3-5-18(6-4-16)24-14-13-23-12-11-21-9-7-17(8-10-21)15-19(22)20-2;1-16-3-5-17(6-4-16)24-14-13-23-12-11-20-7-9-21(10-8-20)15-18(22)19-2;1-14-3-8-18(9-4-14)10-5-15-6-11-19(12-7-15)13-16(20)17-2;1-14-3-7-18(8-4-14)11-12-19-9-5-15(6-10-19)13-16(20)17-2;1-13-5-7-16(8-6-13)19-11-10-18-9-3-4-15-12-14(2)20-17-15;1-13-7-9-16(10-8-13)18-11-5-3-4-6-15-12-14(2)19-17-15;1-14-3-5-17(6-4-14)7-8-18-9-11-19(12-10-18)13-15(20)16-2;1-13-3-7-17(8-4-13)11-14-5-9-18(10-6-14)12-15(19)16-2;1-12-4-6-15(7-5-12)18-9-3-8-17-11-14-10-13(2)19-16-14;1-12-3-5-15(6-4-12)18-10-9-17-8-7-14-11-13(2)19-16-14;1-12-6-8-15(9-7-12)17-10-4-3-5-14-11-13(2)18-16-14;1-12-3-9-17(10-4-12)13-5-7-16(8-6-13)11-14(18)15-2;1-11-3-5-14(6-4-11)17-8-7-16-10-13-9-12(2)18-15-13;1-11-5-7-14(8-6-11)16-9-3-4-13-10-12(2)17-15-13;1-10-3-5-13(6-4-10)15-8-7-12-9-11(2)16-14-12;1-9-3-5-12(6-4-9)14-8-11-7-10(2)15-13-11;1-8-3-5-9(6-4-8)7-10(12)11-2;1-3-4-5-6-7-12-8-9(11)10-2;1-3-4-5-6-11-7-8(10)9-2;1-3-4-5-6-7-8(10)9-2;1-3-4-5-10-6-7(9)8-2;1-3-4-5-6-7(9)8-2;1-3-4-9-5-6(8)7-2/h3-6,17H,7-15H2,1-2H3,(H,20,22);3-6H,7-15H2,1-2H3,(H,19,22);2*14-15H,3-13H2,1-2H3,(H,17,20);5-8,12H,3-4,9-11H2,1-2H3;7-10,12H,3-6,11H2,1-2H3;14H,3-13H2,1-2H3,(H,16,20);13-14H,3-12H2,1-2H3,(H,16,19);4-7,10H,3,8-9,11H2,1-2H3;3-6,11H,7-10H2,1-2H3;6-9,11H,3-5,10H2,1-2H3;12-13H,3-11H2,1-2H3,(H,15,18);3-6,9H,7-8,10H2,1-2H3;5-8,10H,3-4,9H2,1-2H3;3-6,9H,7-8H2,1-2H3;3-7H,8H2,1-2H3;3-6H,7H2,1-2H3,(H,11,12);3-8H2,1-2H3,(H,10,11);3-7H2,1-2H3,(H,9,10);3-7H2,1-2H3,(H,9,10);3-6H2,1-2H3,(H,8,9);3-6H2,1-2H3,(H,8,9);3-5H2,1-2H3,(H,7,8) |
| InChIKey | BNOYDSCFVMBTKL-UHFFFAOYSA-N |
| XLogP | 44.86 |
| TPSA | 880.86 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 67 |
| Rotatable Bonds | 126 |
| Heavy Atoms | 379 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5282.31 |
| LogP ≤ 5 | 44.86 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 67 |