A1A3Y
Summary
| Name: | 2-(2,2-dimethylpyrrolidin-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-(2,2-dimethylpyrrolidin-1-yl)ethan-1-amine |
| OpenEye OEToolkits | 3.1.0.0 | 2-(2,2-dimethylpyrrolidin-1-yl)ethanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC1(C)CCCN1CCN |
| InChI | InChI | 1.06 | InChI=1S/C8H18N2/c1-8(2)4-3-6-10(8)7-5-9/h3-7,9H2,1-2H3 |
| InChIKey | InChI | 1.06 | ZSHAGSDVWLLMSY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1(C)CCCN1CCN |
| SMILES | CACTVS | 3.385 | CC1(C)CCCN1CCN |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC1(CCCN1CCN)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1(CCCN1CCN)C |
