About 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide
2-methoxy-2-methyl-N-thiophen-3-ylpropanamide (PubChem CID 103678845) has the molecular formula C9H13NO2S
and a molecular weight of 199.28 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide.
Molecular Properties
| Compound Name | 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide |
| PubChem CID | 103678845 |
| Molecular Formula | C9H13NO2S |
| Molecular Weight | 199.28 g/mol |
| Exact Mass | 199.07 |
| IUPAC Name | 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide |
| SMILES | COC(C)(C)C(=O)Nc1ccsc1 |
| InChI | InChI=1S/C9H13NO2S/c1-9(2,12-3)8(11)10-7-4-5-13-6-7/h4-6H,1-3H3,(H,10,11) |
| InChIKey | DSIPHKLOLFWGDM-UHFFFAOYSA-N |
| XLogP | 2.11 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.28 |
| LogP ≤ 5 | 2.11 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The IUPAC name of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide (CID 103678845) is 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide is COC(C)(C)C(=O)Nc1ccsc1.
What is the InChIKey of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The InChIKey is DSIPHKLOLFWGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S/c1-9(2,12-3)8(11)10-7-4-5-13-6-7/h4-6H,1-3H3,(H,10,11).
What are the key properties of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
2-methoxy-2-methyl-N-thiophen-3-ylpropanamide has a molecular weight of 199.28 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide is sourced from PubChem (CID 103678845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).