About [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol (PubChem CID 112613122) has the molecular formula C14H14FNO3
and a molecular weight of 263.27 g/mol. Its IUPAC name is [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol.
Molecular Properties
| Compound Name | [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol |
| PubChem CID | 112613122 |
| Molecular Formula | C14H14FNO3 |
| Molecular Weight | 263.27 g/mol |
| Exact Mass | 263.10 |
| IUPAC Name | [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol |
| SMILES | COc1cccc(COc2c(F)cccc2CO)n1 |
| InChI | InChI=1S/C14H14FNO3/c1-18-13-7-3-5-11(16-13)9-19-14-10(8-17)4-2-6-12(14)15/h2-7,17H,8-9H2,1H3 |
| InChIKey | ZCOIQHHEBUUOKO-UHFFFAOYSA-N |
| XLogP | 2.30 |
| TPSA | 51.58 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 263.27 |
| LogP ≤ 5 | 2.30 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol?
The IUPAC name of [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol (CID 112613122) is [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol?
The canonical SMILES for [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol is COc1cccc(COc2c(F)cccc2CO)n1.
What is the InChIKey of [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol?
The InChIKey is ZCOIQHHEBUUOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3/c1-18-13-7-3-5-11(16-13)9-19-14-10(8-17)4-2-6-12(14)15/h2-7,17H,8-9H2,1H3.
What are the key properties of [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol?
[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol has a molecular weight of 263.27 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol is sourced from PubChem (CID 112613122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).