N-{2-[4-(2-Pyrimidinyl)-1-Piperazinyl]Ethyl}-1-Adamantanecarboxamide
Properties
| Property | Value |
|---|---|
| Formula | C21H31N5O |
| IUPAC Name | n-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]adamantane-1-carboxamide |
| Molecular Mass | 369.504 g·mol−1 |
| Heat of Formation | -97.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.60 ± 1.08 D |
| Volume | 458.31 Å 3 |
| Surface Area | 387.49 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | -0.05 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HPFLVTSWRFCPCV-KCPQFBADSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |