C110H92F9N37O5 — CID 160558195
N-[5-(2-cyano-4-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-[5-(6-cyano-3-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;2-[4-(1-cyclopentylpyrazol-4-yl)-3,5-dimethylpyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(2-methylpyrazol-3-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]-N-(5-pyrimidin-2-yl-2-pyridinyl)acetamide (PubChem CID 160558195) has the molecular formula C110H92F9N37O5 and a molecular weight of 2183.18 g/mol. Its IUPAC name is N-[5-(2-cyano-4-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-[5-(6-cyano-3-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;2-[4-(1-cyclopentylpyrazol-4-yl)-3,5-dimethylpyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(2-methylpyrazol-3-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]-N-(5-pyrimidin-2-yl-2-pyridinyl)acetamide.
| Compound Name | N-[5-(2-cyano-4-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-[5-(6-cyano-3-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;2-[4-(1-cyclopentylpyrazol-4-yl)-3,5-dimethylpyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(2-methylpyrazol-3-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]-N-(5-pyrimidin-2-yl-2-pyridinyl)acetamide |
|---|---|
| PubChem CID | 160558195 |
| Molecular Formula | C110H92F9N37O5 |
| Molecular Weight | 2183.18 g/mol |
| Exact Mass | 2181.79 |
| IUPAC Name | N-[5-(2-cyano-4-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;N-[5-(6-cyano-3-pyridinyl)-2-pyridinyl]-2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]acetamide;2-[4-(1-cyclopentylpyrazol-4-yl)-3,5-dimethylpyrazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-(2-methylpyrazol-3-yl)imidazol-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide;2-[5-methyl-4-[2-(trifluoromethyl)-4-pyridinyl]imidazol-1-yl]-N-(5-pyrimidin-2-yl-2-pyridinyl)acetamide |
| SMILES | Cc1c(-c2ccnc(C(F)(F)F)c2)ncn1CC(=O)Nc1ccc(-c2ccc(C#N)nc2)cn1.Cc1c(-c2ccnc(C(F)(F)F)c2)ncn1CC(=O)Nc1ccc(-c2ccnc(C#N)c2)cn1.Cc1c(-c2ccnc(C(F)(F)F)c2)ncn1CC(=O)Nc1ccc(-c2ncccn2)cn1.Cc1c(-c2ccnn2C)ncn1CC(=O)Nc1ccc(-c2cnccn2)cn1.Cc1nn(CC(=O)Nc2ccc(-c3cnccn3)cn2)c(C)c1-c1cnn(C2CCCC2)c1 |
| InChI | InChI=1S/C24H26N8O.2C23H16F3N7O.C21H16F3N7O.C19H18N8O/c1-16-24(19-12-28-32(14-19)20-5-3-4-6-20)17(2)31(30-16)15-23(33)29-22-8-7-18(11-27-22)21-13-25-9-10-26-21;1-14-22(15-6-7-28-19(8-15)23(24,25)26)31-13-33(14)12-21(34)32-20-5-3-17(11-30-20)16-2-4-18(9-27)29-10-16;1-14-22(16-5-7-29-19(9-16)23(24,25)26)31-13-33(14)12-21(34)32-20-3-2-17(11-30-20)15-4-6-28-18(8-15)10-27;1-13-19(14-5-8-25-16(9-14)21(22,23)24)29-12-31(13)11-18(32)30-17-4-3-15(10-28-17)20-26-6-2-7-27-20;1-13-19(16-5-6-24-26(16)2)23-12-27(13)11-18(28)25-17-4-3-14(9-22-17)15-10-20-7-8-21-15/h7-14,20H,3-6,15H2,1-2H3,(H,27,29,33);2-8,10-11,13H,12H2,1H3,(H,30,32,34);2-9,11,13H,12H2,1H3,(H,30,32,34);2-10,12H,11H2,1H3,(H,28,30,32);3-10,12H,11H2,1-2H3,(H,22,25,28) |
| InChIKey | QYYSARQERYQINN-UHFFFAOYSA-N |
| XLogP | 18.29 |
| TPSA | 524.06 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 37 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 161 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2183.18 |
| LogP ≤ 5 | 18.29 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 37 |