2-(4-benzylpiperidin-1-yl)-N'-hydroxybenzenecarboximidamide
Formula:C19H23N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(4-benzylpiperidin-1-yl)-N'-hydroxybenzenecarboximidamide is a drug-like molecule.
| MolName | 2-(4-benzylpiperidin-1-yl)-N'-hydroxybenzenecarboximidamide |
| MolecularFormula | C19H23N3O |
| Smiles | N/C(/c(cccc1)c1N1CCC(Cc2ccccc2)CC1)=N/O |
| InChI | InChI=1S/C19H23N3O/c20-19(21-23)17-8-4-5-9-18(17)22-12-10-16(11-13-22)14-15-6-2-1-3-7-15/h1-9,16,23H,10-14H2,(H2,20,21) |
| InChIK | YWNRWMMCQVWQKG-UHFFFAOYSA-N |
| TotalMolweight | 309.412 |
| Molweight | 309.412 |
| MonoisotopicMass | 309.184112 |
| CLogP | 3.9125 |
| CLogS | -4.367 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 248.96 |
| Relative PSA | 0.17445 |
| PolarSurfaceArea | 61.85 |
| Druglikeness | 3.7278 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6087 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 8 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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