C110H167F3N24O9 — CID 157241201
2-(cyclohexylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(4-methylphenyl)acetamide;2-(dimethylamino)-N-methyl-N-(6-methyl-3-pyridinyl)acetamide;2-(dimethylamino)-N-methyl-N-(2-methylpyrimidin-5-yl)acetamide;N-(3-fluoro-4-methylphenyl)-N-methyl-2-(propan-2-ylamino)acetamide;N-methyl-N-(4-methylphenyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(6-methyl-3-pyridinyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(2-methylpyrimidin-5-yl)-2-(propan-2-ylamino)acetamide (PubChem CID 157241201) has the molecular formula C110H167F3N24O9 and a molecular weight of 2026.70 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(4-methylphenyl)acetamide;2-(dimethylamino)-N-methyl-N-(6-methyl-3-pyridinyl)acetamide;2-(dimethylamino)-N-methyl-N-(2-methylpyrimidin-5-yl)acetamide;N-(3-fluoro-4-methylphenyl)-N-methyl-2-(propan-2-ylamino)acetamide;N-methyl-N-(4-methylphenyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(6-methyl-3-pyridinyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(2-methylpyrimidin-5-yl)-2-(propan-2-ylamino)acetamide.
| Compound Name | 2-(cyclohexylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(4-methylphenyl)acetamide;2-(dimethylamino)-N-methyl-N-(6-methyl-3-pyridinyl)acetamide;2-(dimethylamino)-N-methyl-N-(2-methylpyrimidin-5-yl)acetamide;N-(3-fluoro-4-methylphenyl)-N-methyl-2-(propan-2-ylamino)acetamide;N-methyl-N-(4-methylphenyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(6-methyl-3-pyridinyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(2-methylpyrimidin-5-yl)-2-(propan-2-ylamino)acetamide |
|---|---|
| PubChem CID | 157241201 |
| Molecular Formula | C110H167F3N24O9 |
| Molecular Weight | 2026.70 g/mol |
| Exact Mass | 2025.33 |
| IUPAC Name | 2-(cyclohexylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-(3-fluoro-4-methylphenyl)-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(4-methylphenyl)acetamide;2-(dimethylamino)-N-methyl-N-(6-methyl-3-pyridinyl)acetamide;2-(dimethylamino)-N-methyl-N-(2-methylpyrimidin-5-yl)acetamide;N-(3-fluoro-4-methylphenyl)-N-methyl-2-(propan-2-ylamino)acetamide;N-methyl-N-(4-methylphenyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(6-methyl-3-pyridinyl)-2-(propan-2-ylamino)acetamide;N-methyl-N-(2-methylpyrimidin-5-yl)-2-(propan-2-ylamino)acetamide |
| SMILES | Cc1ccc(N(C)C(=O)CN(C)C)cc1.Cc1ccc(N(C)C(=O)CN(C)C)cc1F.Cc1ccc(N(C)C(=O)CN(C)C)cn1.Cc1ccc(N(C)C(=O)CNC(C)C)cc1.Cc1ccc(N(C)C(=O)CNC(C)C)cc1F.Cc1ccc(N(C)C(=O)CNC(C)C)cn1.Cc1ccc(N(C)C(=O)CNC2CCCCC2)cc1F.Cc1ncc(N(C)C(=O)CN(C)C)cn1.Cc1ncc(N(C)C(=O)CNC(C)C)cn1 |
| InChI | InChI=1S/C16H23FN2O.C13H19FN2O.C13H20N2O.C12H17FN2O.C12H19N3O.C12H18N2O.C11H18N4O.C11H17N3O.C10H16N4O/c1-12-8-9-14(10-15(12)17)19(2)16(20)11-18-13-6-4-3-5-7-13;1-9(2)15-8-13(17)16(4)11-6-5-10(3)12(14)7-11;1-10(2)14-9-13(16)15(4)12-7-5-11(3)6-8-12;1-9-5-6-10(7-11(9)13)15(4)12(16)8-14(2)3;1-9(2)13-8-12(16)15(4)11-6-5-10(3)14-7-11;1-10-5-7-11(8-6-10)14(4)12(15)9-13(2)3;1-8(2)12-7-11(16)15(4)10-5-13-9(3)14-6-10;1-9-5-6-10(7-12-9)14(4)11(15)8-13(2)3;1-8-11-5-9(6-12-8)14(4)10(15)7-13(2)3/h8-10,13,18H,3-7,11H2,1-2H3;5-7,9,15H,8H2,1-4H3;5-8,10,14H,9H2,1-4H3;5-7H,8H2,1-4H3;5-7,9,13H,8H2,1-4H3;5-8H,9H2,1-4H3;5-6,8,12H,7H2,1-4H3;5-7H,8H2,1-4H3;5-6H,7H2,1-4H3 |
| InChIKey | AVFSNMYIWCJGKL-UHFFFAOYSA-N |
| XLogP | 13.57 |
| TPSA | 333.24 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 32 |
| Heavy Atoms | 146 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2026.70 |
| LogP ≤ 5 | 13.57 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 24 |