C13H16N2OS — CID 106660484
5-methoxy-2-methyl-N-(1-thiophen-3-ylethyl)pyridin-4-amine (PubChem CID 106660484) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is 5-methoxy-2-methyl-N-(1-thiophen-3-ylethyl)pyridin-4-amine.
| Compound Name | 5-methoxy-2-methyl-N-(1-thiophen-3-ylethyl)pyridin-4-amine |
|---|---|
| PubChem CID | 106660484 |
| Molecular Formula | C13H16N2OS |
| Molecular Weight | 248.35 g/mol |
| Exact Mass | 248.10 |
| IUPAC Name | 5-methoxy-2-methyl-N-(1-thiophen-3-ylethyl)pyridin-4-amine |
| SMILES | COc1cnc(C)cc1NC(C)c1ccsc1 |
| InChI | InChI=1S/C13H16N2OS/c1-9-6-12(13(16-3)7-14-9)15-10(2)11-4-5-17-8-11/h4-8,10H,1-3H3,(H,14,15) |
| InChIKey | AJAMTTJTWBOFBP-UHFFFAOYSA-N |
| XLogP | 3.63 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 248.35 |
| LogP ≤ 5 | 3.63 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |