About 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol
1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol (PubChem CID 104800764) has the molecular formula C11H14N2O2
and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol.
Molecular Properties
| Compound Name | 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol |
| PubChem CID | 104800764 |
| Molecular Formula | C11H14N2O2 |
| Molecular Weight | 206.25 g/mol |
| Exact Mass | 206.11 |
| IUPAC Name | 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol |
| SMILES | Cc1ccoc1C(O)Cc1nccn1C |
| InChI | InChI=1S/C11H14N2O2/c1-8-3-6-15-11(8)9(14)7-10-12-4-5-13(10)2/h3-6,9,14H,7H2,1-2H3 |
| InChIKey | QRSXBOMAMVAQKD-UHFFFAOYSA-N |
| XLogP | 1.60 |
| TPSA | 51.19 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 206.25 |
| LogP ≤ 5 | 1.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol?
The IUPAC name of 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol (CID 104800764) is 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol is Cc1ccoc1C(O)Cc1nccn1C.
What is the InChIKey of 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol?
The InChIKey is QRSXBOMAMVAQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-8-3-6-15-11(8)9(14)7-10-12-4-5-13(10)2/h3-6,9,14H,7H2,1-2H3.
What are the key properties of 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol?
1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol has a molecular weight of 206.25 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylfuran-2-yl)-2-(1-methylimidazol-2-yl)ethanol is sourced from PubChem (CID 104800764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).