(E)-N-(2-morpholin-4-ylphenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Formula:C20H19N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-(2-morpholin-4-ylphenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide is a drug-like molecule.
| MolName | (E)-N-(2-morpholin-4-ylphenyl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide |
| MolecularFormula | C20H19N2O2F3 |
| Smiles | O=C(/C=C/c1cccc(C(F)(F)F)c1)Nc(cccc1)c1N1CCOCC1 |
| InChI | InChI=1S/C20H19F3N2O2/c21-20(22,23)16-5-3-4-15(14-16)8-9-19(26)24-17-6-1-2-7-18(17)25-10-12-27-13-11-25/h1-9,14H,10-13H2,(H,24,26) |
| InChIK | DXIJNXXJEDCYMA-UHFFFAOYSA-N |
| TotalMolweight | 376.377 |
| Molweight | 376.377 |
| MonoisotopicMass | 376.139862 |
| CLogP | 3.6536 |
| CLogS | -4.379 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 280.03 |
| Relative PSA | 0.13588 |
| PolarSurfaceArea | 41.57 |
| Druglikeness | -6.1989 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 7 |
| Symmetricatoms | 4 |
| Amides | 1 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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