[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol

C13H12FNO2 — CID 113378794

IUPAC[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol
SMILESCc1cc(CO)cc(Oc2ccc(F)cc2)n1
InChIInChI=1S/C13H12FNO2/c1-9-6-10(8-16)7-13(15-9)17-12-4-2-11(14)3-5-12/h2-7,16H,8H2,1H3
InChIKeyGRBMBQFKYMVPEZ-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.81
Rot. Bonds3

About [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol

[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol (PubChem CID 113378794) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol
PubChem CID113378794
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol
SMILESCc1cc(CO)cc(Oc2ccc(F)cc2)n1
InChIInChI=1S/C13H12FNO2/c1-9-6-10(8-16)7-13(15-9)17-12-4-2-11(14)3-5-12/h2-7,16H,8H2,1H3
InChIKeyGRBMBQFKYMVPEZ-UHFFFAOYSA-N
XLogP2.81
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 ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol?
The IUPAC name of [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol (CID 113378794) is [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol.
What is the SMILES notation for [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol?
The canonical SMILES for [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol is Cc1cc(CO)cc(Oc2ccc(F)cc2)n1.
What is the InChIKey of [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol?
The InChIKey is GRBMBQFKYMVPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2/c1-9-6-10(8-16)7-13(15-9)17-12-4-2-11(14)3-5-12/h2-7,16H,8H2,1H3.
What are the key properties of [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol?
[2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol has a molecular weight of 233.24 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenoxy)-6-methyl-4-pyridinyl]methanol is sourced from PubChem (CID 113378794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).