About methyl 2-(2-carbamoylphenoxy)acetate
methyl 2-(2-carbamoylphenoxy)acetate (PubChem CID 2772027) has the molecular formula C10H11NO4
and a molecular weight of 209.20 g/mol. Its IUPAC name is methyl 2-(2-carbamoylphenoxy)acetate.
Molecular Properties
| Compound Name | methyl 2-(2-carbamoylphenoxy)acetate |
| PubChem CID | 2772027 |
| Molecular Formula | C10H11NO4 |
| Molecular Weight | 209.20 g/mol |
| Exact Mass | 209.07 |
| IUPAC Name | methyl 2-(2-carbamoylphenoxy)acetate |
| SMILES | COC(=O)COc1ccccc1C(N)=O |
| InChI | InChI=1S/C10H11NO4/c1-14-9(12)6-15-8-5-3-2-4-7(8)10(11)13/h2-5H,6H2,1H3,(H2,11,13) |
| InChIKey | TUIIPYHNEPTKMR-UHFFFAOYSA-N |
| XLogP | 0.34 |
| TPSA | 78.62 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.20 |
| LogP ≤ 5 | 0.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of methyl 2-(2-carbamoylphenoxy)acetate?
The IUPAC name of methyl 2-(2-carbamoylphenoxy)acetate (CID 2772027) is methyl 2-(2-carbamoylphenoxy)acetate.
What is the SMILES notation for methyl 2-(2-carbamoylphenoxy)acetate?
The canonical SMILES for methyl 2-(2-carbamoylphenoxy)acetate is COC(=O)COc1ccccc1C(N)=O.
What is the InChIKey of methyl 2-(2-carbamoylphenoxy)acetate?
The InChIKey is TUIIPYHNEPTKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-14-9(12)6-15-8-5-3-2-4-7(8)10(11)13/h2-5H,6H2,1H3,(H2,11,13).
What are the key properties of methyl 2-(2-carbamoylphenoxy)acetate?
methyl 2-(2-carbamoylphenoxy)acetate has a molecular weight of 209.20 g/mol, XLogP of 0.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-carbamoylphenoxy)acetate is sourced from PubChem (CID 2772027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).