| MolName | N-[(Z)-1-(4-chlorophenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]furan-2-carboxamide |
| MolecularFormula | C19H19N2O3Cl |
| Smiles | O=C(/C(/NC(c1ccco1)=O)=C/c(cc1)ccc1Cl)N1CCCCC1 |
| InChI | InChI=1S/C19H19ClN2O3/c20-15-8-6-14(7-9-15)13-16(19(24)22-10-2-1-3-11-22)21-18(23)17-5-4-12-25-17/h4-9,12-13H,1-3,10-11H2,(H,21,23) |
| InChIK | IGCXHGXUWAERNW-UHFFFAOYSA-N |
| TotalMolweight | 358.824 |
| Molweight | 358.824 |
| MonoisotopicMass | 358.10842 |
| CLogP | 3.9093 |
| CLogS | -4.378 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 275.4 |
| Relative PSA | 0.20044 |
| PolarSurfaceArea | 62.55 |
| Druglikeness | 3.4568 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
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1 - N-[(Z)-1-(4-chlorophenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]furan-2-carboxamide | 2 - N-[(Z)-1-(4-chlorophenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]furan-2-carboxamide