C182H287N11O49 — CID 160812423
2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenoxy)ethoxy]acetamide;N-methyl-2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]acetamide;N-methyl-2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetamide;N-methyl-3-(4-methylphenoxy)propanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide;N-methyl-3-(4-methylphenyl)propanamide;1-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]butan-2-one;1-[2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one;2-(4-methylphenyl)ethyl N-methylcarbamate (PubChem CID 160812423) has the molecular formula C182H287N11O49 and a molecular weight of 3413.33 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenoxy)ethoxy]acetamide;N-methyl-2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]acetamide;N-methyl-2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetamide;N-methyl-3-(4-methylphenoxy)propanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide;N-methyl-3-(4-methylphenyl)propanamide;1-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]butan-2-one;1-[2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one;2-(4-methylphenyl)ethyl N-methylcarbamate.
| Compound Name | 2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenoxy)ethoxy]acetamide;N-methyl-2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]acetamide;N-methyl-2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetamide;N-methyl-3-(4-methylphenoxy)propanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide;N-methyl-3-(4-methylphenyl)propanamide;1-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]butan-2-one;1-[2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one;2-(4-methylphenyl)ethyl N-methylcarbamate |
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| PubChem CID | 160812423 |
| Molecular Formula | C182H287N11O49 |
| Molecular Weight | 3413.33 g/mol |
| Exact Mass | 3411.03 |
| IUPAC Name | 2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenoxy)ethoxy]acetamide;N-methyl-2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]acetamide;N-methyl-2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetamide;N-methyl-3-(4-methylphenoxy)propanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide;N-methyl-3-(4-methylphenyl)propanamide;1-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]butan-2-one;1-[2-[2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one;2-(4-methylphenyl)ethyl N-methylcarbamate |
| SMILES | CCC(=O)COCCOCCOCCOCCOCCOc1ccc(C)cc1.CCC(=O)COCCOCCOCCOc1ccc(C)cc1.CCCCOCCOCCOCCOCCOCC(=O)NC.CCCCOCCOCCOCCOCCOCCOCC(=O)NC.CNC(=O)CCCOc1ccc(C)cc1.CNC(=O)CCOc1ccc(C)cc1.CNC(=O)CCc1ccc(C)cc1.CNC(=O)COCCOCCOCCOCCOc1ccc(C)cc1.CNC(=O)COCCOCCOc1ccc(C)cc1.CNC(=O)COCCOc1ccc(C)cc1.CNC(=O)COCCc1ccc(C)cc1.CNC(=O)COCc1ccc(C)cc1.CNC(=O)OCCc1ccc(C)cc1 |
| InChI | InChI=1S/C21H34O7.C18H29NO6.C17H35NO7.C17H26O5.C15H31NO6.C14H21NO4.C12H17NO3.2C12H17NO2.3C11H15NO2.C11H15NO/c1-3-20(22)18-27-15-14-25-11-10-23-8-9-24-12-13-26-16-17-28-21-6-4-19(2)5-7-21;1-16-3-5-17(6-4-16)25-14-13-23-10-9-21-7-8-22-11-12-24-15-18(20)19-2;1-3-4-5-20-6-7-21-8-9-22-10-11-23-12-13-24-14-15-25-16-17(19)18-2;1-3-16(18)14-21-11-10-19-8-9-20-12-13-22-17-6-4-15(2)5-7-17;1-3-4-5-18-6-7-19-8-9-20-10-11-21-12-13-22-14-15(17)16-2;1-12-3-5-13(6-4-12)19-10-9-17-7-8-18-11-14(16)15-2;1-10-3-5-11(6-4-10)16-8-7-15-9-12(14)13-2;1-10-3-5-11(6-4-10)7-8-15-9-12(14)13-2;1-10-5-7-11(8-6-10)15-9-3-4-12(14)13-2;1-9-3-5-10(6-4-9)7-14-8-11(13)12-2;1-9-3-5-10(6-4-9)14-8-7-11(13)12-2;1-9-3-5-10(6-4-9)7-8-14-11(13)12-2;1-9-3-5-10(6-4-9)7-8-11(13)12-2/h4-7H,3,8-18H2,1-2H3;3-6H,7-15H2,1-2H3,(H,19,20);3-16H2,1-2H3,(H,18,19);4-7H,3,8-14H2,1-2H3;3-14H2,1-2H3,(H,16,17);3-6H,7-11H2,1-2H3,(H,15,16);3-6H,7-9H2,1-2H3,(H,13,14);3-6H,7-9H2,1-2H3,(H,13,14);5-8H,3-4,9H2,1-2H3,(H,13,14);3*3-6H,7-8H2,1-2H3,(H,12,13);3-6H,7-8H2,1-2H3,(H,12,13) |
| InChIKey | SELWZDZMAPSFNH-UHFFFAOYSA-N |
| XLogP | 19.10 |
| TPSA | 686.52 Ų |
| H-Bond Donors | 11 |
| H-Bond Acceptors | 49 |
| Rotatable Bonds | 123 |
| Heavy Atoms | 242 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3413.33 |
| LogP ≤ 5 | 19.10 |
| H-Bond Donors ≤ 5 | 11 |
| H-Bond Acceptors ≤ 10 | 49 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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