About 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol
1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol (PubChem CID 82575997) has the molecular formula C15H19NO2
and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol.
Molecular Properties
| Compound Name | 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol |
| PubChem CID | 82575997 |
| Molecular Formula | C15H19NO2 |
| Molecular Weight | 245.32 g/mol |
| Exact Mass | 245.14 |
| IUPAC Name | 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol |
| SMILES | Cc1cc(C(C)O)nc2c(OC(C)C)cccc12 |
| InChI | InChI=1S/C15H19NO2/c1-9(2)18-14-7-5-6-12-10(3)8-13(11(4)17)16-15(12)14/h5-9,11,17H,1-4H3 |
| InChIKey | GUGRBXGYZQPHEI-UHFFFAOYSA-N |
| XLogP | 3.38 |
| TPSA | 42.35 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.32 |
| LogP ≤ 5 | 3.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol?
The IUPAC name of 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol (CID 82575997) is 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol.
What is the SMILES notation for 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol?
The canonical SMILES for 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol is Cc1cc(C(C)O)nc2c(OC(C)C)cccc12.
What is the InChIKey of 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol?
The InChIKey is GUGRBXGYZQPHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-9(2)18-14-7-5-6-12-10(3)8-13(11(4)17)16-15(12)14/h5-9,11,17H,1-4H3.
What are the key properties of 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol?
1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol has a molecular weight of 245.32 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol is sourced from PubChem (CID 82575997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).