W3J
Summary
| Name: | 1,4,5,6-tetrahydropyrimidin-2-amine |
| Formula: | C4 H9 N3 |
| Formal charge: | 0 |
| Formula weight: | 99.134 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1,4,5,6-tetrahydropyrimidin-2-amine |
| OpenEye OEToolkits | 2.0.7 | 1,4,5,6-tetrahydropyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N1C(N)=NCCC1 |
| InChI | InChI | 1.03 | InChI=1S/C4H9N3/c5-4-6-2-1-3-7-4/h1-3H2,(H3,5,6,7) |
| InChIKey | InChI | 1.03 | PEHDFSFYZKSKGH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1=NCCCN1 |
| SMILES | CACTVS | 3.385 | NC1=NCCCN1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CNC(=NC1)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CNC(=NC1)N |
