| MolName | (E)-3-(furan-2-yl)-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]prop-2-enamide |
| MolecularFormula | C14H18N2O4 |
| Smiles | O=C(CNC(/C=C/c1ccco1)=O)NCC1OCCC1 |
| InChI | InChI=1S/C14H18N2O4/c17-13(6-5-11-3-1-7-19-11)16-10-14(18)15-9-12-4-2-8-20-12/h1,3,5-7,12H,2,4,8-10H2,(H,15,18)(H,16,17)/t12-/m1/s1 |
| InChIK | RTVQZCKPLXVZLE-GFCCVEGCSA-N |
| TotalMolweight | 278.307 |
| Molweight | 278.307 |
| MonoisotopicMass | 278.126658 |
| CLogP | -2.00E-04 |
| CLogS | -2.125 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 225.67 |
| Relative PSA | 0.32397 |
| PolarSurfaceArea | 80.57 |
| Druglikeness | -0.2575 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3Atoms | 7 |
| Amides | 2 |
| StereoCon | racemate |
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1 - (E)-3-(furan-2-yl)-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]prop-2-enamide | 2 - (E)-3-(furan-2-yl)-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]prop-2-enamide