HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 57779639Generated: November 2, 2026
Methyl 2-phenyl-2-(1-(pyrimidin-2-yl)piperidin-4-yl)acetate
https://huagongshe.com/en/chemical/57779639
Identifiers & Physical Properties
| Molecular formula | C18H21N3O2 |
|---|
| Average molar mass | 311.4 g/mol |
|---|
| Monoisotopic mass | 311.16337692 g/mol |
|---|
| SMILES | COC(=O)C(c1ccccc1)C1CCN(c2ncccn2)CC1 |
|---|
| InChIKey | QRFSIMYBEPENMW-UHFFFAOYSA-N |
|---|
| PubChem CID | 57779639 |
|---|
Chemical & Physical Properties
| XLogP | 2.9 |
|---|
| Topological polar surface area | 55.3 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 5 |
|---|
| Rotatable bonds | 5 |
|---|
| Heavy atoms | 23 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 370 |
|---|
