[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol

C14H14FNO3 — CID 112613122

IUPAC[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
SMILESCOc1cccc(COc2c(F)cccc2CO)n1
InChIInChI=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
InChIKeyZCOIQHHEBUUOKO-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.30
Rot. Bonds5

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 CID112613122
Molecular FormulaC14H14FNO3
Molecular Weight263.27 g/mol
Exact Mass263.10
IUPAC Name[3-fluoro-2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methanol
SMILESCOc1cccc(COc2c(F)cccc2CO)n1
InChIInChI=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
InChIKeyZCOIQHHEBUUOKO-UHFFFAOYSA-N
XLogP2.30
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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).