About 2-ethyl-3-(furan-2-ylmethyl)pyridine
2-ethyl-3-(furan-2-ylmethyl)pyridine (PubChem CID 173468661) has the molecular formula C12H13NO
and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-ethyl-3-(furan-2-ylmethyl)pyridine.
Molecular Properties
| Compound Name | 2-ethyl-3-(furan-2-ylmethyl)pyridine |
| PubChem CID | 173468661 |
| Molecular Formula | C12H13NO |
| Molecular Weight | 187.24 g/mol |
| Exact Mass | 187.10 |
| IUPAC Name | 2-ethyl-3-(furan-2-ylmethyl)pyridine |
| SMILES | CCc1ncccc1Cc1ccco1 |
| InChI | InChI=1S/C12H13NO/c1-2-12-10(5-3-7-13-12)9-11-6-4-8-14-11/h3-8H,2,9H2,1H3 |
| InChIKey | BRYJQXLAEJOYJF-UHFFFAOYSA-N |
| XLogP | 2.83 |
| TPSA | 26.03 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 187.24 |
| LogP ≤ 5 | 2.83 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The IUPAC name of 2-ethyl-3-(furan-2-ylmethyl)pyridine (CID 173468661) is 2-ethyl-3-(furan-2-ylmethyl)pyridine.
What is the SMILES notation for 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The canonical SMILES for 2-ethyl-3-(furan-2-ylmethyl)pyridine is CCc1ncccc1Cc1ccco1.
What is the InChIKey of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The InChIKey is BRYJQXLAEJOYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-2-12-10(5-3-7-13-12)9-11-6-4-8-14-11/h3-8H,2,9H2,1H3.
What are the key properties of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
2-ethyl-3-(furan-2-ylmethyl)pyridine has a molecular weight of 187.24 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(furan-2-ylmethyl)pyridine is sourced from PubChem (CID 173468661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).