WQ7
Summary
| Name: | 1-(2-aminoethyl)pyridin-2(1H)-one |
| Formula: | C7 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 138.167 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(2-aminoethyl)pyridin-2(1H)-one |
| OpenEye OEToolkits | 2.0.7 | 1-(2-azanylethyl)pyridin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NCCN1C(C=CC=C1)=O |
| InChI | InChI | 1.03 | InChI=1S/C7H10N2O/c8-4-6-9-5-2-1-3-7(9)10/h1-3,5H,4,6,8H2 |
| InChIKey | InChI | 1.03 | IZSOENLZRWXCER-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCN1C=CC=CC1=O |
| SMILES | CACTVS | 3.385 | NCCN1C=CC=CC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1=CC(=O)N(C=C1)CCN |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1=CC(=O)N(C=C1)CCN |
