About 2-methoxy-1-thiophen-3-ylpentan-1-ol
2-methoxy-1-thiophen-3-ylpentan-1-ol (PubChem CID 116711807) has the molecular formula C10H16O2S
and a molecular weight of 200.30 g/mol. Its IUPAC name is 2-methoxy-1-thiophen-3-ylpentan-1-ol.
Molecular Properties
| Compound Name | 2-methoxy-1-thiophen-3-ylpentan-1-ol |
| PubChem CID | 116711807 |
| Molecular Formula | C10H16O2S |
| Molecular Weight | 200.30 g/mol |
| Exact Mass | 200.09 |
| IUPAC Name | 2-methoxy-1-thiophen-3-ylpentan-1-ol |
| SMILES | CCCC(OC)C(O)c1ccsc1 |
| InChI | InChI=1S/C10H16O2S/c1-3-4-9(12-2)10(11)8-5-6-13-7-8/h5-7,9-11H,3-4H2,1-2H3 |
| InChIKey | HZXWPNZIERDTLO-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.30 |
| LogP ≤ 5 | 2.60 |
| 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-3-ylpentan-1-ol?
The IUPAC name of 2-methoxy-1-thiophen-3-ylpentan-1-ol (CID 116711807) is 2-methoxy-1-thiophen-3-ylpentan-1-ol.
What is the SMILES notation for 2-methoxy-1-thiophen-3-ylpentan-1-ol?
The canonical SMILES for 2-methoxy-1-thiophen-3-ylpentan-1-ol is CCCC(OC)C(O)c1ccsc1.
What is the InChIKey of 2-methoxy-1-thiophen-3-ylpentan-1-ol?
The InChIKey is HZXWPNZIERDTLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2S/c1-3-4-9(12-2)10(11)8-5-6-13-7-8/h5-7,9-11H,3-4H2,1-2H3.
What are the key properties of 2-methoxy-1-thiophen-3-ylpentan-1-ol?
2-methoxy-1-thiophen-3-ylpentan-1-ol has a molecular weight of 200.30 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-thiophen-3-ylpentan-1-ol is sourced from PubChem (CID 116711807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).