C156H201N35O10 — CID 160976335
4-(5-methylpyrazin-2-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethane-1,2-dione;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(2-methylpyrimidin-5-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;1-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(2-methylpyrimidin-5-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;(4-propan-2-ylphenyl) 4-(6-methylpyridazin-3-yl)piperazine-1-carboxylate (PubChem CID 160976335) has the molecular formula C156H201N35O10 and a molecular weight of 2726.56 g/mol. Its IUPAC name is 4-(5-methylpyrazin-2-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethane-1,2-dione;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(2-methylpyrimidin-5-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;1-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(2-methylpyrimidin-5-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;(4-propan-2-ylphenyl) 4-(6-methylpyridazin-3-yl)piperazine-1-carboxylate.
| Compound Name | 4-(5-methylpyrazin-2-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethane-1,2-dione;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(2-methylpyrimidin-5-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;1-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(2-methylpyrimidin-5-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;(4-propan-2-ylphenyl) 4-(6-methylpyridazin-3-yl)piperazine-1-carboxylate |
|---|---|
| PubChem CID | 160976335 |
| Molecular Formula | C156H201N35O10 |
| Molecular Weight | 2726.56 g/mol |
| Exact Mass | 2724.63 |
| IUPAC Name | 4-(5-methylpyrazin-2-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethane-1,2-dione;1-[4-(6-methylpyridazin-3-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;1-[4-(2-methylpyrimidin-5-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;1-[4-(4-methylpyrimidin-2-yl)piperazin-1-yl]-2-(4-propan-2-ylphenyl)ethanone;4-(2-methylpyrimidin-5-yl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;(4-propan-2-ylphenyl) 4-(6-methylpyridazin-3-yl)piperazine-1-carboxylate |
| SMILES | Cc1ccc(N2CCN(C(=O)C(=O)c3ccc(C(C)C)cc3)CC2)nn1.Cc1ccc(N2CCN(C(=O)Cc3ccc(C(C)C)cc3)CC2)nn1.Cc1ccc(N2CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)nn1.Cc1ccc(N2CCN(C(=O)Oc3ccc(C(C)C)cc3)CC2)nn1.Cc1ccnc(N2CCN(C(=O)Cc3ccc(C(C)C)cc3)CC2)n1.Cc1cnc(N2CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)cn1.Cc1ncc(N2CCN(C(=O)Cc3ccc(C(C)C)cc3)CC2)cn1.Cc1ncc(N2CCN(C(=O)Nc3ccc(C(C)C)cc3)CC2)cn1 |
| InChI | InChI=1S/C20H24N4O2.3C20H26N4O.3C19H25N5O.C19H24N4O2/c1-14(2)16-5-7-17(8-6-16)19(25)20(26)24-12-10-23(11-13-24)18-9-4-15(3)21-22-18;1-15(2)18-7-5-17(6-8-18)14-20(25)24-12-10-23(11-13-24)19-9-4-16(3)21-22-19;1-15(2)18-6-4-17(5-7-18)12-20(25)24-10-8-23(9-11-24)19-13-21-16(3)22-14-19;1-15(2)18-6-4-17(5-7-18)14-19(25)23-10-12-24(13-11-23)20-21-9-8-16(3)22-20;1-14(2)16-5-7-17(8-6-16)20-19(25)24-12-10-23(11-13-24)18-9-4-15(3)21-22-18;1-14(2)16-4-6-17(7-5-16)22-19(25)24-10-8-23(9-11-24)18-12-20-15(3)21-13-18;1-14(2)16-4-6-17(7-5-16)22-19(25)24-10-8-23(9-11-24)18-13-20-15(3)12-21-18;1-14(2)16-5-7-17(8-6-16)25-19(24)23-12-10-22(11-13-23)18-9-4-15(3)20-21-18/h4-9,14H,10-13H2,1-3H3;4-9,15H,10-14H2,1-3H3;4-7,13-15H,8-12H2,1-3H3;4-9,15H,10-14H2,1-3H3;4-9,14H,10-13H2,1-3H3,(H,20,25);2*4-7,12-14H,8-11H2,1-3H3,(H,22,25);4-9,14H,10-13H2,1-3H3 |
| InChIKey | SYXNJZGMPXABGK-UHFFFAOYSA-N |
| XLogP | 23.86 |
| TPSA | 457.03 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 34 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 201 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2726.56 |
| LogP ≤ 5 | 23.86 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 34 |
| Structural Alerts | {'alert_name': 'diketo_group', 'substructure': 'N/A'} |
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