About 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide
2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide (PubChem CID 168526436) has the molecular formula C13H13NO4
and a molecular weight of 247.25 g/mol. Its IUPAC name is 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide.
Molecular Properties
| Compound Name | 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide |
| PubChem CID | 168526436 |
| Molecular Formula | C13H13NO4 |
| Molecular Weight | 247.25 g/mol |
| Exact Mass | 247.08 |
| IUPAC Name | 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide |
| SMILES | COc1cc(-c2ccco2)ccc1OCC(N)=O |
| InChI | InChI=1S/C13H13NO4/c1-16-12-7-9(10-3-2-6-17-10)4-5-11(12)18-8-13(14)15/h2-7H,8H2,1H3,(H2,14,15) |
| InChIKey | CIGGQMNOEDTSSJ-UHFFFAOYSA-N |
| XLogP | 1.82 |
| TPSA | 74.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 247.25 |
| LogP ≤ 5 | 1.82 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide?
The IUPAC name of 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide (CID 168526436) is 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide.
What is the SMILES notation for 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide?
The canonical SMILES for 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide is COc1cc(-c2ccco2)ccc1OCC(N)=O.
What is the InChIKey of 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide?
The InChIKey is CIGGQMNOEDTSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO4/c1-16-12-7-9(10-3-2-6-17-10)4-5-11(12)18-8-13(14)15/h2-7H,8H2,1H3,(H2,14,15).
What are the key properties of 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide?
2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide has a molecular weight of 247.25 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-2-yl)-2-methoxyphenoxy]acetamide is sourced from PubChem (CID 168526436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).