(E)-N-benzyl-N-(cyclobutylmethyl)-3-phenylprop-2-enamide
Formula:C21H23NO
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-benzyl-N-(cyclobutylmethyl)-3-phenylprop-2-enamide is a drug-like molecule.
| MolName | (E)-N-benzyl-N-(cyclobutylmethyl)-3-phenylprop-2-enamide |
| MolecularFormula | C21H23NO |
| Smiles | O=C(/C=C/c1ccccc1)N(CC1CCC1)Cc1ccccc1 |
| InChI | InChI=1S/C21H23NO/c23-21(15-14-18-8-3-1-4-9-18)22(17-20-12-7-13-20)16-19-10-5-2-6-11-19/h1-6,8-11,14-15,20H,7,12-13,16-17H2 |
| InChIK | AEGPLGGXJYVOCK-UHFFFAOYSA-N |
| TotalMolweight | 305.42 |
| Molweight | 305.42 |
| MonoisotopicMass | 305.177964 |
| CLogP | 4.1786 |
| CLogS | -4.038 |
| H Acceptors | 2 |
| TotalSurfaceArea | 255.37 |
| Relative PSA | 0.064965 |
| PolarSurfaceArea | 20.31 |
| Druglikeness | 1.8907 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56522 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 5 |
| Amides | 1 |
| StereoCon |
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