C208H219F5N20O24 — CID 157350660
5-[5-[2-[3-(difluoromethyl)phenyl]acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;5-[5-[2-(3-ethylphenyl)acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;2-methyl-2-[3-[2-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-2-oxoethyl]phenyl]propanenitrile;1-methyl-5-[2-methyl-5-(2-phenylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-(3-propan-2-ylphenyl)acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-2-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-3-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-[4-(trifluoromethyl)-2-pyridinyl]acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one (PubChem CID 157350660) has the molecular formula C208H219F5N20O24 and a molecular weight of 3478.15 g/mol. Its IUPAC name is 5-[5-[2-[3-(difluoromethyl)phenyl]acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;5-[5-[2-(3-ethylphenyl)acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;2-methyl-2-[3-[2-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-2-oxoethyl]phenyl]propanenitrile;1-methyl-5-[2-methyl-5-(2-phenylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-(3-propan-2-ylphenyl)acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-2-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-3-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-[4-(trifluoromethyl)-2-pyridinyl]acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one.
| Compound Name | 5-[5-[2-[3-(difluoromethyl)phenyl]acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;5-[5-[2-(3-ethylphenyl)acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;2-methyl-2-[3-[2-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-2-oxoethyl]phenyl]propanenitrile;1-methyl-5-[2-methyl-5-(2-phenylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-(3-propan-2-ylphenyl)acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-2-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-3-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-[4-(trifluoromethyl)-2-pyridinyl]acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one |
|---|---|
| PubChem CID | 157350660 |
| Molecular Formula | C208H219F5N20O24 |
| Molecular Weight | 3478.15 g/mol |
| Exact Mass | 3475.65 |
| IUPAC Name | 5-[5-[2-[3-(difluoromethyl)phenyl]acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;5-[5-[2-(3-ethylphenyl)acetyl]-2-methylphenyl]-1-methyl-3-morpholin-4-ylpyridin-2-one;2-methyl-2-[3-[2-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)phenyl]-2-oxoethyl]phenyl]propanenitrile;1-methyl-5-[2-methyl-5-(2-phenylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-(3-propan-2-ylphenyl)acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-2-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-(2-pyridin-3-ylacetyl)phenyl]-3-morpholin-4-ylpyridin-2-one;1-methyl-5-[2-methyl-5-[2-[4-(trifluoromethyl)-2-pyridinyl]acetyl]phenyl]-3-morpholin-4-ylpyridin-2-one |
| SMILES | CCc1cccc(CC(=O)c2ccc(C)c(-c3cc(N4CCOCC4)c(=O)n(C)c3)c2)c1.Cc1ccc(C(=O)Cc2cc(C(F)(F)F)ccn2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2cccc(C(C)(C)C#N)c2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2cccc(C(C)C)c2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2cccc(C(F)F)c2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2ccccc2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2ccccn2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1.Cc1ccc(C(=O)Cc2cccnc2)cc1-c1cc(N2CCOCC2)c(=O)n(C)c1 |
| InChI | InChI=1S/C29H31N3O3.C28H32N2O3.C27H30N2O3.C26H26F2N2O3.C25H24F3N3O3.C25H26N2O3.2C24H25N3O3/c1-20-8-9-22(27(33)15-21-6-5-7-24(14-21)29(2,3)19-30)16-25(20)23-17-26(28(34)31(4)18-23)32-10-12-35-13-11-32;1-19(2)22-7-5-6-21(14-22)15-27(31)23-9-8-20(3)25(16-23)24-17-26(28(32)29(4)18-24)30-10-12-33-13-11-30;1-4-20-6-5-7-21(14-20)15-26(30)22-9-8-19(2)24(16-22)23-17-25(27(31)28(3)18-23)29-10-12-32-13-11-29;1-17-6-7-19(24(31)13-18-4-3-5-20(12-18)25(27)28)14-22(17)21-15-23(26(32)29(2)16-21)30-8-10-33-11-9-30;1-16-3-4-17(23(32)14-20-13-19(5-6-29-20)25(26,27)28)11-21(16)18-12-22(24(33)30(2)15-18)31-7-9-34-10-8-31;1-18-8-9-20(24(28)14-19-6-4-3-5-7-19)15-22(18)21-16-23(25(29)26(2)17-21)27-10-12-30-13-11-27;1-17-5-6-19(23(28)12-18-4-3-7-25-15-18)13-21(17)20-14-22(24(29)26(2)16-20)27-8-10-30-11-9-27;1-17-6-7-18(23(28)15-20-5-3-4-8-25-20)13-21(17)19-14-22(24(29)26(2)16-19)27-9-11-30-12-10-27/h5-9,14,16-18H,10-13,15H2,1-4H3;5-9,14,16-19H,10-13,15H2,1-4H3;5-9,14,16-18H,4,10-13,15H2,1-3H3;3-7,12,14-16,25H,8-11,13H2,1-2H3;3-6,11-13,15H,7-10,14H2,1-2H3;3-9,15-17H,10-14H2,1-2H3;3-7,13-16H,8-12H2,1-2H3;3-8,13-14,16H,9-12,15H2,1-2H3 |
| InChIKey | BHMKJMHLGFZFAY-UHFFFAOYSA-N |
| XLogP | 31.61 |
| TPSA | 474.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 44 |
| Rotatable Bonds | 44 |
| Heavy Atoms | 257 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3478.15 |
| LogP ≤ 5 | 31.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 44 |