C160H216F6N34O6 — CID 158267630
5-[2-cyclobutyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopentyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;1-[3-[2-(cyclopropylmethyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazine;4-[3-[2-(2,2-dimethylpropyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]morpholine;bis(5-[2-(2,2-dimethylpropyl)-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine);3-methyl-5-[1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)-2-propan-2-ylimidazol-4-yl]pyridin-2-amine (PubChem CID 158267630) has the molecular formula C160H216F6N34O6 and a molecular weight of 2825.71 g/mol. Its IUPAC name is 5-[2-cyclobutyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopentyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;1-[3-[2-(cyclopropylmethyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazine;4-[3-[2-(2,2-dimethylpropyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]morpholine;bis(5-[2-(2,2-dimethylpropyl)-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine);3-methyl-5-[1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)-2-propan-2-ylimidazol-4-yl]pyridin-2-amine.
| Compound Name | 5-[2-cyclobutyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopentyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;1-[3-[2-(cyclopropylmethyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazine;4-[3-[2-(2,2-dimethylpropyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]morpholine;bis(5-[2-(2,2-dimethylpropyl)-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine);3-methyl-5-[1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)-2-propan-2-ylimidazol-4-yl]pyridin-2-amine |
|---|---|
| PubChem CID | 158267630 |
| Molecular Formula | C160H216F6N34O6 |
| Molecular Weight | 2825.71 g/mol |
| Exact Mass | 2823.75 |
| IUPAC Name | 5-[2-cyclobutyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;5-[2-cyclopentyl-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine;1-[3-[2-(cyclopropylmethyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]-4-methylpiperazine;4-[3-[2-(2,2-dimethylpropyl)-4-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]imidazol-1-yl]-1-bicyclo[1.1.1]pentanyl]morpholine;bis(5-[2-(2,2-dimethylpropyl)-1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)imidazol-4-yl]-3-methylpyridin-2-amine);3-methyl-5-[1-(3-morpholin-4-yl-1-bicyclo[1.1.1]pentanyl)-2-propan-2-ylimidazol-4-yl]pyridin-2-amine |
| SMILES | Cc1cc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(C(C)C)n2)cnc1N.Cc1cc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(C3CCC3)n2)cnc1N.Cc1cc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(C3CCCC3)n2)cnc1N.Cc1cc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(CC(C)(C)C)n2)cnc1N.Cc1cc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(CC(C)(C)C)n2)cnc1N.Cc1ncc(-c2cn(C34CC(N5CCN(C)CC5)(C3)C4)c(CC3CC3)n2)cc1C(F)(F)F.Cc1ncc(-c2cn(C34CC(N5CCOCC5)(C3)C4)c(CC(C)(C)C)n2)cc1C(F)(F)F |
| InChI | InChI=1S/C24H30F3N5.C24H31F3N4O.C23H31N5O.2C23H33N5O.C22H29N5O.C21H29N5O/c1-16-19(24(25,26)27)10-18(11-28-16)20-12-32(21(29-20)9-17-3-4-17)23-13-22(14-23,15-23)31-7-5-30(2)6-8-31;1-16-18(24(25,26)27)9-17(11-28-16)19-12-31(20(29-19)10-21(2,3)4)23-13-22(14-23,15-23)30-5-7-32-8-6-30;1-16-10-18(11-25-20(16)24)19-12-28(21(26-19)17-4-2-3-5-17)23-13-22(14-23,15-23)27-6-8-29-9-7-27;2*1-16-9-17(11-25-20(16)24)18-12-28(19(26-18)10-21(2,3)4)23-13-22(14-23,15-23)27-5-7-29-8-6-27;1-15-9-17(10-24-19(15)23)18-11-27(20(25-18)16-3-2-4-16)22-12-21(13-22,14-22)26-5-7-28-8-6-26;1-14(2)19-24-17(16-8-15(3)18(22)23-9-16)10-26(19)21-11-20(12-21,13-21)25-4-6-27-7-5-25/h10-12,17H,3-9,13-15H2,1-2H3;9,11-12H,5-8,10,13-15H2,1-4H3;10-12,17H,2-9,13-15H2,1H3,(H2,24,25);2*9,11-12H,5-8,10,13-15H2,1-4H3,(H2,24,25);9-11,16H,2-8,12-14H2,1H3,(H2,23,24);8-10,14H,4-7,11-13H2,1-3H3,(H2,22,23) |
| InChIKey | GIQKNZDRNOQDSW-UHFFFAOYSA-N |
| XLogP | 25.15 |
| TPSA | 426.37 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 40 |
| Rotatable Bonds | 29 |
| Heavy Atoms | 206 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2825.71 |
| LogP ≤ 5 | 25.15 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 40 |