(E)-N-[2-(furan-2-ylmethyl)cyclohexyl]-3-phenylprop-2-enamide
Formula:C20H23NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-[2-(furan-2-ylmethyl)cyclohexyl]-3-phenylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-[2-(furan-2-ylmethyl)cyclohexyl]-3-phenylprop-2-enamide |
| MolecularFormula | C20H23NO2 |
| Smiles | O=C(/C=C/c1ccccc1)NC1C(Cc2ccco2)CCCC1 |
| InChI | InChI=1S/C20H23NO2/c22-20(13-12-16-7-2-1-3-8-16)21-19-11-5-4-9-17(19)15-18-10-6-14-23-18/h1-3,6-8,10,12-14,17,19H,4-5,9,11,15H2,(H,21,22) |
| InChIK | KXEYICQCKZUATP-UHFFFAOYSA-N |
| TotalMolweight | 309.408 |
| Molweight | 309.408 |
| MonoisotopicMass | 309.172879 |
| CLogP | 3.8832 |
| CLogS | -4.542 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 258.72 |
| Relative PSA | 0.14923 |
| PolarSurfaceArea | 42.24 |
| Druglikeness | -3.8941 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6087 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 2 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 7 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon | unknown chirality |
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1 - (E)-N-[2-(furan-2-ylmethyl)cyclohexyl]-3-phenylprop-2-enamide | 2 - (E)-N-[2-(furan-2-ylmethyl)cyclohexyl]-3-phenylprop-2-enamide
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