About 6-quinolin-7-yloxyhexan-1-ol
6-quinolin-7-yloxyhexan-1-ol (PubChem CID 107705479) has the molecular formula C15H19NO2
and a molecular weight of 245.32 g/mol. Its IUPAC name is 6-quinolin-7-yloxyhexan-1-ol.
Molecular Properties
| Compound Name | 6-quinolin-7-yloxyhexan-1-ol |
| PubChem CID | 107705479 |
| Molecular Formula | C15H19NO2 |
| Molecular Weight | 245.32 g/mol |
| Exact Mass | 245.14 |
| IUPAC Name | 6-quinolin-7-yloxyhexan-1-ol |
| SMILES | OCCCCCCOc1ccc2cccnc2c1 |
| InChI | InChI=1S/C15H19NO2/c17-10-3-1-2-4-11-18-14-8-7-13-6-5-9-16-15(13)12-14/h5-9,12,17H,1-4,10-11H2 |
| InChIKey | AWLSZVWFKPFPCO-UHFFFAOYSA-N |
| XLogP | 3.17 |
| TPSA | 42.35 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.32 |
| LogP ≤ 5 | 3.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-quinolin-7-yloxyhexan-1-ol?
The IUPAC name of 6-quinolin-7-yloxyhexan-1-ol (CID 107705479) is 6-quinolin-7-yloxyhexan-1-ol.
What is the SMILES notation for 6-quinolin-7-yloxyhexan-1-ol?
The canonical SMILES for 6-quinolin-7-yloxyhexan-1-ol is OCCCCCCOc1ccc2cccnc2c1.
What is the InChIKey of 6-quinolin-7-yloxyhexan-1-ol?
The InChIKey is AWLSZVWFKPFPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-10-3-1-2-4-11-18-14-8-7-13-6-5-9-16-15(13)12-14/h5-9,12,17H,1-4,10-11H2.
What are the key properties of 6-quinolin-7-yloxyhexan-1-ol?
6-quinolin-7-yloxyhexan-1-ol has a molecular weight of 245.32 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-quinolin-7-yloxyhexan-1-ol is sourced from PubChem (CID 107705479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).