About N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide
N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide (PubChem CID 33287828) has the molecular formula C14H15NO2S
and a molecular weight of 261.35 g/mol. Its IUPAC name is N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide.
Molecular Properties
| Compound Name | N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide |
| PubChem CID | 33287828 |
| Molecular Formula | C14H15NO2S |
| Molecular Weight | 261.35 g/mol |
| Exact Mass | 261.08 |
| IUPAC Name | N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide |
| SMILES | COCc1cccc(NC(=O)Cc2cccs2)c1 |
| InChI | InChI=1S/C14H15NO2S/c1-17-10-11-4-2-5-12(8-11)15-14(16)9-13-6-3-7-18-13/h2-8H,9-10H2,1H3,(H,15,16) |
| InChIKey | PFIYMPCOFSCBSD-UHFFFAOYSA-N |
| XLogP | 3.08 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 261.35 |
| LogP ≤ 5 | 3.08 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide (CID 33287828) is N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide is COCc1cccc(NC(=O)Cc2cccs2)c1.
What is the InChIKey of N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide?
The InChIKey is PFIYMPCOFSCBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-17-10-11-4-2-5-12(8-11)15-14(16)9-13-6-3-7-18-13/h2-8H,9-10H2,1H3,(H,15,16).
What are the key properties of N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide?
N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide has a molecular weight of 261.35 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methoxymethyl)phenyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 33287828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).