C15H15N3S — CID 81231313
2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine (PubChem CID 81231313) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine.
| Compound Name | 2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine |
|---|---|
| PubChem CID | 81231313 |
| Molecular Formula | C15H15N3S |
| Molecular Weight | 269.37 g/mol |
| Exact Mass | 269.10 |
| IUPAC Name | 2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanamine |
| SMILES | Cc1csc(CC(N)c2cccc3ncccc23)n1 |
| InChI | InChI=1S/C15H15N3S/c1-10-9-19-15(18-10)8-13(16)11-4-2-6-14-12(11)5-3-7-17-14/h2-7,9,13H,8,16H2,1H3 |
| InChIKey | LOPYTOZDMWZGMA-UHFFFAOYSA-N |
| XLogP | 3.24 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 269.37 |
| LogP ≤ 5 | 3.24 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |