C127H260N32O17 — CID 167617976
2-[4-(4-methoxybutyl)piperazin-1-yl]-N-methylacetamide;2-[4-[2-(2-methoxyethoxy)ethyl]piperazin-1-yl]-N-methylacetamide;2-[1-[2-(2-methoxyethoxy)ethyl]piperidin-4-yl]-N-methylacetamide;2-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylacetamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylprop-1-en-2-amine;3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine;2-[4-(5-methoxypentyl)piperazin-1-yl]-N-methylacetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]acetamide (PubChem CID 167617976) has the molecular formula C127H260N32O17 and a molecular weight of 2507.68 g/mol. Its IUPAC name is 2-[4-(4-methoxybutyl)piperazin-1-yl]-N-methylacetamide;2-[4-[2-(2-methoxyethoxy)ethyl]piperazin-1-yl]-N-methylacetamide;2-[1-[2-(2-methoxyethoxy)ethyl]piperidin-4-yl]-N-methylacetamide;2-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylacetamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylprop-1-en-2-amine;3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine;2-[4-(5-methoxypentyl)piperazin-1-yl]-N-methylacetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]acetamide.
| Compound Name | 2-[4-(4-methoxybutyl)piperazin-1-yl]-N-methylacetamide;2-[4-[2-(2-methoxyethoxy)ethyl]piperazin-1-yl]-N-methylacetamide;2-[1-[2-(2-methoxyethoxy)ethyl]piperidin-4-yl]-N-methylacetamide;2-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylacetamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylprop-1-en-2-amine;3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine;2-[4-(5-methoxypentyl)piperazin-1-yl]-N-methylacetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]acetamide |
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| PubChem CID | 167617976 |
| Molecular Formula | C127H260N32O17 |
| Molecular Weight | 2507.68 g/mol |
| Exact Mass | 2506.05 |
| IUPAC Name | 2-[4-(4-methoxybutyl)piperazin-1-yl]-N-methylacetamide;2-[4-[2-(2-methoxyethoxy)ethyl]piperazin-1-yl]-N-methylacetamide;2-[1-[2-(2-methoxyethoxy)ethyl]piperidin-4-yl]-N-methylacetamide;2-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylacetamide;3-[4-(2-methoxyethyl)piperazin-1-yl]-N-methylprop-1-en-2-amine;3-[1-(2-methoxyethyl)piperidin-4-yl]-N-methylprop-1-en-2-amine;2-[4-(5-methoxypentyl)piperazin-1-yl]-N-methylacetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]acetamide;N-methyl-2-[1-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-yl]acetamide;N-methyl-2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]acetamide |
| SMILES | C=C(CC1CCN(CCOC)CC1)NC.C=C(CN1CCN(CCOC)CC1)NC.CNC(=O)CC1CCN(CCN2CCN(C)CC2)CC1.CNC(=O)CC1CCN(CCOCCOC)CC1.CNC(=O)CN1CCC(CCN2CCN(C)CC2)CC1.CNC(=O)CN1CCN(CCCCCOC)CC1.CNC(=O)CN1CCN(CCCCOC)CC1.CNC(=O)CN1CCN(CCN2CCN(C)CC2)CC1.CNC(=O)CN1CCN(CCOC)CC1.CNC(=O)CN1CCN(CCOCCOC)CC1 |
| InChI | InChI=1S/2C15H30N4O.C14H29N5O.C13H27N3O2.C13H26N2O3.C12H25N3O3.C12H25N3O2.C12H24N2O.C11H23N3O.C10H21N3O2/c1-16-15(20)13-19-7-4-14(5-8-19)3-6-18-11-9-17(2)10-12-18;1-16-15(20)13-14-3-5-18(6-4-14)11-12-19-9-7-17(2)8-10-19;1-15-14(20)13-19-11-9-18(10-12-19)8-7-17-5-3-16(2)4-6-17;1-14-13(17)12-16-9-7-15(8-10-16)6-4-3-5-11-18-2;1-14-13(16)11-12-3-5-15(6-4-12)7-8-18-10-9-17-2;1-13-12(16)11-15-5-3-14(4-6-15)7-8-18-10-9-17-2;1-13-12(16)11-15-8-6-14(7-9-15)5-3-4-10-17-2;1-11(13-2)10-12-4-6-14(7-5-12)8-9-15-3;1-11(12-2)10-14-6-4-13(5-7-14)8-9-15-3;1-11-10(14)9-13-5-3-12(4-6-13)7-8-15-2/h2*14H,3-13H2,1-2H3,(H,16,20);3-13H2,1-2H3,(H,15,20);3-12H2,1-2H3,(H,14,17);12H,3-11H2,1-2H3,(H,14,16);3-11H2,1-2H3,(H,13,16);3-11H2,1-2H3,(H,13,16);12-13H,1,4-10H2,2-3H3;12H,1,4-10H2,2-3H3;3-9H2,1-2H3,(H,11,14) |
| InChIKey | MAHYUXKGJXOTRU-UHFFFAOYSA-N |
| XLogP | -1.34 |
| TPSA | 411.21 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 41 |
| Rotatable Bonds | 63 |
| Heavy Atoms | 176 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2507.68 |
| LogP ≤ 5 | -1.34 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 41 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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