(E)-N-(2-morpholin-4-ylethyl)-3-phenylprop-2-en-1-amine
Formula:C15H22N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-(2-morpholin-4-ylethyl)-3-phenylprop-2-en-1-amine is a drug-like molecule.
| MolName | (E)-N-(2-morpholin-4-ylethyl)-3-phenylprop-2-en-1-amine |
| MolecularFormula | C15H22N2O |
| Smiles | C(CN1CCOCC1)NC/C=C/c1ccccc1 |
| InChI | InChI=1S/C15H22N2O/c1-2-5-15(6-3-1)7-4-8-16-9-10-17-11-13-18-14-12-17/h1-7,16H,8-14H2 |
| InChIK | HYRSJROMDFPZTK-UHFFFAOYSA-N |
| TotalMolweight | 246.353 |
| Molweight | 246.353 |
| MonoisotopicMass | 246.173213 |
| CLogP | 1.446 |
| CLogS | -1.499 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 214.34 |
| Relative PSA | 0.11668 |
| PolarSurfaceArea | 24.5 |
| Druglikeness | 2.525 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.77778 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 10 |
| Symmetricatoms | 4 |
| Amines | 2 |
| AlkylAmines | 2 |
| BasicNitrogens | 2 |
| StereoCon |
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