About 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol
4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol (PubChem CID 157454667) has the molecular formula C15H17NO3S
and a molecular weight of 291.37 g/mol. Its IUPAC name is 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol.
Molecular Properties
| Compound Name | 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol |
| PubChem CID | 157454667 |
| Molecular Formula | C15H17NO3S |
| Molecular Weight | 291.37 g/mol |
| Exact Mass | 291.09 |
| IUPAC Name | 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol |
| SMILES | CCSc1cc(OCc2ccc(OC)cc2)ncc1O |
| InChI | InChI=1S/C15H17NO3S/c1-3-20-14-8-15(16-9-13(14)17)19-10-11-4-6-12(18-2)7-5-11/h4-9,17H,3,10H2,1-2H3 |
| InChIKey | OEQWBGIWTUKAKF-UHFFFAOYSA-N |
| XLogP | 3.49 |
| TPSA | 51.58 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.37 |
| LogP ≤ 5 | 3.49 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol?
The IUPAC name of 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol (CID 157454667) is 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol.
What is the SMILES notation for 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol?
The canonical SMILES for 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol is CCSc1cc(OCc2ccc(OC)cc2)ncc1O.
What is the InChIKey of 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol?
The InChIKey is OEQWBGIWTUKAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c1-3-20-14-8-15(16-9-13(14)17)19-10-11-4-6-12(18-2)7-5-11/h4-9,17H,3,10H2,1-2H3.
What are the key properties of 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol?
4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol has a molecular weight of 291.37 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfanyl-6-[(4-methoxyphenyl)methoxy]pyridin-3-ol is sourced from PubChem (CID 157454667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).