About 2-(5-methyl-1H-indol-2-yl)ethanol
2-(5-methyl-1H-indol-2-yl)ethanol (PubChem CID 83674310) has the molecular formula C11H13NO
and a molecular weight of 175.23 g/mol. Its IUPAC name is 2-(5-methyl-1H-indol-2-yl)ethanol.
Molecular Properties
| Compound Name | 2-(5-methyl-1H-indol-2-yl)ethanol |
| PubChem CID | 83674310 |
| Molecular Formula | C11H13NO |
| Molecular Weight | 175.23 g/mol |
| Exact Mass | 175.10 |
| IUPAC Name | 2-(5-methyl-1H-indol-2-yl)ethanol |
| SMILES | Cc1ccc2[nH]c(CCO)cc2c1 |
| InChI | InChI=1S/C11H13NO/c1-8-2-3-11-9(6-8)7-10(12-11)4-5-13/h2-3,6-7,12-13H,4-5H2,1H3 |
| InChIKey | WDBUPLIZIIMLPL-UHFFFAOYSA-N |
| XLogP | 2.01 |
| TPSA | 36.02 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 175.23 |
| LogP ≤ 5 | 2.01 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-methyl-1H-indol-2-yl)ethanol?
The IUPAC name of 2-(5-methyl-1H-indol-2-yl)ethanol (CID 83674310) is 2-(5-methyl-1H-indol-2-yl)ethanol.
What is the SMILES notation for 2-(5-methyl-1H-indol-2-yl)ethanol?
The canonical SMILES for 2-(5-methyl-1H-indol-2-yl)ethanol is Cc1ccc2[nH]c(CCO)cc2c1.
What is the InChIKey of 2-(5-methyl-1H-indol-2-yl)ethanol?
The InChIKey is WDBUPLIZIIMLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-8-2-3-11-9(6-8)7-10(12-11)4-5-13/h2-3,6-7,12-13H,4-5H2,1H3.
What are the key properties of 2-(5-methyl-1H-indol-2-yl)ethanol?
2-(5-methyl-1H-indol-2-yl)ethanol has a molecular weight of 175.23 g/mol, XLogP of 2.01, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-indol-2-yl)ethanol is sourced from PubChem (CID 83674310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).