About 2-methoxy-1-thiophen-2-ylethanamine
2-methoxy-1-thiophen-2-ylethanamine (PubChem CID 58736274) has the molecular formula C7H11NOS
and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-methoxy-1-thiophen-2-ylethanamine.
Molecular Properties
| Compound Name | 2-methoxy-1-thiophen-2-ylethanamine |
| PubChem CID | 58736274 |
| Molecular Formula | C7H11NOS |
| Molecular Weight | 157.24 g/mol |
| Exact Mass | 157.06 |
| IUPAC Name | 2-methoxy-1-thiophen-2-ylethanamine |
| SMILES | COCC(N)c1cccs1 |
| InChI | InChI=1S/C7H11NOS/c1-9-5-6(8)7-3-2-4-10-7/h2-4,6H,5,8H2,1H3 |
| InChIKey | PWDPKBLJEXAOCF-UHFFFAOYSA-N |
| XLogP | 1.39 |
| TPSA | 35.25 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 157.24 |
| LogP ≤ 5 | 1.39 |
| 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-1-thiophen-2-ylethanamine?
The IUPAC name of 2-methoxy-1-thiophen-2-ylethanamine (CID 58736274) is 2-methoxy-1-thiophen-2-ylethanamine.
What is the SMILES notation for 2-methoxy-1-thiophen-2-ylethanamine?
The canonical SMILES for 2-methoxy-1-thiophen-2-ylethanamine is COCC(N)c1cccs1.
What is the InChIKey of 2-methoxy-1-thiophen-2-ylethanamine?
The InChIKey is PWDPKBLJEXAOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NOS/c1-9-5-6(8)7-3-2-4-10-7/h2-4,6H,5,8H2,1H3.
What are the key properties of 2-methoxy-1-thiophen-2-ylethanamine?
2-methoxy-1-thiophen-2-ylethanamine has a molecular weight of 157.24 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-thiophen-2-ylethanamine is sourced from PubChem (CID 58736274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).