A1A3X
Summary
| Name: | 2-[(2S)-2-methylpiperidin-1-yl]ethan-1-amine |
| Formula: | C8 H18 N2 |
| Formal charge: | 0 |
| Formula weight: | 142.242 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-[(2S)-2-methylpiperidin-1-yl]ethan-1-amine |
| OpenEye OEToolkits | 3.1.0.0 | 2-[(2~{R})-2-methylpiperidin-1-yl]ethanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NCCN1CCCCC1C |
| InChI | InChI | 1.06 | InChI=1S/C8H18N2/c1-8-4-2-3-6-10(8)7-5-9/h8H,2-7,9H2,1H3/t8-/m0/s1 |
| InChIKey | InChI | 1.06 | DBSDZVMWEMKFCH-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1CCCCN1CCN |
| SMILES | CACTVS | 3.385 | C[CH]1CCCCN1CCN |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@@H]1CCCCN1CCN |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1CCCCN1CCN |
