8U7
Summary
| Name: | N-(1-benzylpiperidin-4-yl)-N'-methylurea |
| Formula: | C14 H21 N3 O |
| Formal charge: | 0 |
| Formula weight: | 247.336 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(1-benzylpiperidin-4-yl)-N'-methylurea |
| OpenEye OEToolkits | 2.0.6 | 1-methyl-3-[1-(phenylmethyl)piperidin-4-yl]urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C)C(NC1CCN(CC1)Cc2ccccc2)=O |
| InChI | InChI | 1.03 | InChI=1S/C14H21N3O/c1-15-14(18)16-13-7-9-17(10-8-13)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H2,15,16,18) |
| InChIKey | InChI | 1.03 | YCESGSGSKWSGFX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)NC1CCN(CC1)Cc2ccccc2 |
| SMILES | CACTVS | 3.385 | CNC(=O)NC1CCN(CC1)Cc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNC(=O)NC1CCN(CC1)Cc2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)NC1CCN(CC1)Cc2ccccc2 |
