C148H129F6N49O7 — CID 161005200
2-[2,5-dimethyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2,5-dimethyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide (PubChem CID 161005200) has the molecular formula C148H129F6N49O7 and a molecular weight of 2819.98 g/mol. Its IUPAC name is 2-[2,5-dimethyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2,5-dimethyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide.
| Compound Name | 2-[2,5-dimethyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2,5-dimethyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide |
|---|---|
| PubChem CID | 161005200 |
| Molecular Formula | C148H129F6N49O7 |
| Molecular Weight | 2819.98 g/mol |
| Exact Mass | 2818.11 |
| IUPAC Name | 2-[2,5-dimethyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2,5-dimethyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(2-methyl-4-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[2-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(6-methyl-3-pyridinyl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[4-(6-methyl-3-pyridinyl)pyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[6-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide |
| SMILES | Cc1c(-c2ccc(C(F)(F)F)nc2)ncn1CC(=O)Nc1ccc(-c2cnccn2)cn1.Cc1cc(-c2cn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c(C)n2)ccn1.Cc1ccc(-c2cn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c(C)n2)cn1.Cc1ccc(-c2cnn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c2)cn1.Cc1ccc(-c2nc(C)n(CC(=O)Nc3ccc(-c4cnccn4)cn3)c2C)cn1.Cc1ccc(-c2ncn(CC(=O)Nc3ccc(-c4cnccn4)cn3)c2C)cn1.Cc1nc(-c2ccc(C(F)(F)F)nc2)c(C)n1CC(=O)Nc1ccc(-c2cnccn2)cn1 |
| InChI | InChI=1S/C22H18F3N7O.C22H21N7O.C21H16F3N7O.3C21H19N7O.C20H17N7O/c1-13-21(16-3-5-18(28-10-16)22(23,24)25)30-14(2)32(13)12-20(33)31-19-6-4-15(9-29-19)17-11-26-7-8-27-17;1-14-4-5-18(11-25-14)22-15(2)29(16(3)27-22)13-21(30)28-20-7-6-17(10-26-20)19-12-23-8-9-24-19;1-13-20(15-2-4-17(27-9-15)21(22,23)24)29-12-31(13)11-19(32)30-18-5-3-14(8-28-18)16-10-25-6-7-26-16;1-14-9-16(5-6-23-14)19-12-28(15(2)26-19)13-21(29)27-20-4-3-17(10-25-20)18-11-22-7-8-24-18;1-14-3-4-17(9-24-14)19-12-28(15(2)26-19)13-21(29)27-20-6-5-16(10-25-20)18-11-22-7-8-23-18;1-14-3-4-17(10-24-14)21-15(2)28(13-26-21)12-20(29)27-19-6-5-16(9-25-19)18-11-22-7-8-23-18;1-14-2-3-15(8-23-14)17-10-25-27(12-17)13-20(28)26-19-5-4-16(9-24-19)18-11-21-6-7-22-18/h3-11H,12H2,1-2H3,(H,29,31,33);4-12H,13H2,1-3H3,(H,26,28,30);2-10,12H,11H2,1H3,(H,28,30,32);2*3-12H,13H2,1-2H3,(H,25,27,29);3-11,13H,12H2,1-2H3,(H,25,27,29);2-12H,13H2,1H3,(H,24,26,28) |
| InChIKey | TWKIMRMILSYEDZ-UHFFFAOYSA-N |
| XLogP | 23.10 |
| TPSA | 689.36 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 49 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 210 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2819.98 |
| LogP ≤ 5 | 23.10 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 49 |