About 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol
2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol (PubChem CID 117180167) has the molecular formula C15H12FNO2
and a molecular weight of 257.26 g/mol. Its IUPAC name is 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol.
Molecular Properties
| Compound Name | 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol |
| PubChem CID | 117180167 |
| Molecular Formula | C15H12FNO2 |
| Molecular Weight | 257.26 g/mol |
| Exact Mass | 257.09 |
| IUPAC Name | 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol |
| SMILES | Oc1ccccc1OCc1cc2ccc(F)cc2[nH]1 |
| InChI | InChI=1S/C15H12FNO2/c16-11-6-5-10-7-12(17-13(10)8-11)9-19-15-4-2-1-3-14(15)18/h1-8,17-18H,9H2 |
| InChIKey | LKESVQWBQWGLQX-UHFFFAOYSA-N |
| XLogP | 3.59 |
| TPSA | 45.25 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.26 |
| LogP ≤ 5 | 3.59 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol?
The IUPAC name of 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol (CID 117180167) is 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol.
What is the SMILES notation for 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol?
The canonical SMILES for 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol is Oc1ccccc1OCc1cc2ccc(F)cc2[nH]1.
What is the InChIKey of 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol?
The InChIKey is LKESVQWBQWGLQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO2/c16-11-6-5-10-7-12(17-13(10)8-11)9-19-15-4-2-1-3-14(15)18/h1-8,17-18H,9H2.
What are the key properties of 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol?
2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol has a molecular weight of 257.26 g/mol, XLogP of 3.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol is sourced from PubChem (CID 117180167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).