4-[(E)-3-(furan-2-yl)prop-2-enyl]morpholine
Formula:C11H15NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-[(E)-3-(furan-2-yl)prop-2-enyl]morpholine is a drug-like molecule.
| MolName | 4-[(E)-3-(furan-2-yl)prop-2-enyl]morpholine |
| MolecularFormula | C11H15NO2 |
| Smiles | C(/C=C/c1ccco1)N1CCOCC1 |
| InChI | InChI=1S/C11H15NO2/c1(3-11-4-2-8-14-11)5-12-6-9-13-10-7-12/h1-4,8H,5-7,9-10H2 |
| InChIK | QCVZBQYHXWRXGO-UHFFFAOYSA-N |
| TotalMolweight | 193.245 |
| Molweight | 193.245 |
| MonoisotopicMass | 193.110279 |
| CLogP | 1.2014 |
| CLogS | -1.396 |
| H Acceptors | 3 |
| TotalSurfaceArea | 165.05 |
| Relative PSA | 0.16759 |
| PolarSurfaceArea | 25.61 |
| Druglikeness | 1.4008 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3Atoms | 7 |
| Symmetricatoms | 2 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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