About 2-(5-methyl-1H-imidazol-2-yl)ethanol
2-(5-methyl-1H-imidazol-2-yl)ethanol (PubChem CID 68798957) has the molecular formula C6H10N2O
and a molecular weight of 126.16 g/mol. Its IUPAC name is 2-(5-methyl-1H-imidazol-2-yl)ethanol.
Molecular Properties
| Compound Name | 2-(5-methyl-1H-imidazol-2-yl)ethanol |
| PubChem CID | 68798957 |
| Molecular Formula | C6H10N2O |
| Molecular Weight | 126.16 g/mol |
| Exact Mass | 126.08 |
| IUPAC Name | 2-(5-methyl-1H-imidazol-2-yl)ethanol |
| SMILES | Cc1cnc(CCO)[nH]1 |
| InChI | InChI=1S/C6H10N2O/c1-5-4-7-6(8-5)2-3-9/h4,9H,2-3H2,1H3,(H,7,8) |
| InChIKey | YAWMJRXASOZKLQ-UHFFFAOYSA-N |
| XLogP | 0.25 |
| TPSA | 48.91 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 126.16 |
| LogP ≤ 5 | 0.25 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)ethanol?
The IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)ethanol (CID 68798957) is 2-(5-methyl-1H-imidazol-2-yl)ethanol.
What is the SMILES notation for 2-(5-methyl-1H-imidazol-2-yl)ethanol?
The canonical SMILES for 2-(5-methyl-1H-imidazol-2-yl)ethanol is Cc1cnc(CCO)[nH]1.
What is the InChIKey of 2-(5-methyl-1H-imidazol-2-yl)ethanol?
The InChIKey is YAWMJRXASOZKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-5-4-7-6(8-5)2-3-9/h4,9H,2-3H2,1H3,(H,7,8).
What are the key properties of 2-(5-methyl-1H-imidazol-2-yl)ethanol?
2-(5-methyl-1H-imidazol-2-yl)ethanol has a molecular weight of 126.16 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-imidazol-2-yl)ethanol is sourced from PubChem (CID 68798957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).