[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol

C13H12FNO2 — CID 56720679

IUPAC[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol
SMILESCOc1cncc(-c2ccc(F)c(CO)c2)c1
InChIInChI=1S/C13H12FNO2/c1-17-12-5-10(6-15-7-12)9-2-3-13(14)11(4-9)8-16/h2-7,16H,8H2,1H3
InChIKeyGCYAJDOBFNYUTP-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.39
Rot. Bonds3

About [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol

[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol (PubChem CID 56720679) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol.

Molecular Properties

Compound Name[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol
PubChem CID56720679
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol
SMILESCOc1cncc(-c2ccc(F)c(CO)c2)c1
InChIInChI=1S/C13H12FNO2/c1-17-12-5-10(6-15-7-12)9-2-3-13(14)11(4-9)8-16/h2-7,16H,8H2,1H3
InChIKeyGCYAJDOBFNYUTP-UHFFFAOYSA-N
XLogP2.39
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol?
The IUPAC name of [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol (CID 56720679) is [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol.
What is the SMILES notation for [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol?
The canonical SMILES for [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol is COc1cncc(-c2ccc(F)c(CO)c2)c1.
What is the InChIKey of [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol?
The InChIKey is GCYAJDOBFNYUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2/c1-17-12-5-10(6-15-7-12)9-2-3-13(14)11(4-9)8-16/h2-7,16H,8H2,1H3.
What are the key properties of [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol?
[2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol has a molecular weight of 233.24 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-5-(5-methoxy-3-pyridinyl)phenyl]methanol is sourced from PubChem (CID 56720679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).