[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol

C13H12FNO2 — CID 131870314

IUPAC[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol
SMILESCOc1ncc(CO)cc1-c1ccccc1F
InChIInChI=1S/C13H12FNO2/c1-17-13-11(6-9(8-16)7-15-13)10-4-2-3-5-12(10)14/h2-7,16H,8H2,1H3
InChIKeyIFFKBIFCWYXTBG-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.39
Rot. Bonds3

About [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol

[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol (PubChem CID 131870314) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol
PubChem CID131870314
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol
SMILESCOc1ncc(CO)cc1-c1ccccc1F
InChIInChI=1S/C13H12FNO2/c1-17-13-11(6-9(8-16)7-15-13)10-4-2-3-5-12(10)14/h2-7,16H,8H2,1H3
InChIKeyIFFKBIFCWYXTBG-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 [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol?
The IUPAC name of [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol (CID 131870314) is [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol.
What is the SMILES notation for [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol?
The canonical SMILES for [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol is COc1ncc(CO)cc1-c1ccccc1F.
What is the InChIKey of [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol?
The InChIKey is IFFKBIFCWYXTBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2/c1-17-13-11(6-9(8-16)7-15-13)10-4-2-3-5-12(10)14/h2-7,16H,8H2,1H3.
What are the key properties of [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol?
[5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]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 [5-(2-fluorophenyl)-6-methoxy-3-pyridinyl]methanol is sourced from PubChem (CID 131870314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).