(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol

C14H14FNO2 — CID 102989853

IUPAC(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol
SMILESCc1ccc(F)cc1Oc1ccc([C@H](C)O)cn1
InChIInChI=1S/C14H14FNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3/t10-/m0/s1
InChIKeyORPYODDMUILQCO-JTQLQIEISA-N
MW247.27 g/mol
LogP3.37
Rot. Bonds3

About (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol

(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol (PubChem CID 102989853) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol
PubChem CID102989853
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol
SMILESCc1ccc(F)cc1Oc1ccc([C@H](C)O)cn1
InChIInChI=1S/C14H14FNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3/t10-/m0/s1
InChIKeyORPYODDMUILQCO-JTQLQIEISA-N
XLogP3.37
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.27
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol
CID 107284929
6-(5-fluoro-2-methylphenoxy)pyridin-3-amine
CID 102980228
(1S)-1-[6-(4-bromo-3,5-dimethylphenoxy)-3-pyridinyl]ethanol
CID 107724994
1-[6-(4-bromo-3,5-dimethylphenoxy)-3-pyridinyl]ethanol
CID 107724992
(1R)-1-[6-(4-bromo-5-fluoro-2-nitrophenoxy)-3-pyridinyl]ethanol
CID 103483375
[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 61255694
1-[6-(4-bromo-2,5-dichlorophenoxy)-3-pyridinyl]ethanol
CID 107659083
(4-fluorophenyl)-(6-methoxy-3-pyridinyl)methanol
CID 58882938
1-[6-(2,4-difluorophenyl)-3-pyridinyl]ethanol
CID 143762249
4-fluoro-6-(2-methyl-5-propan-2-ylphenoxy)pyrimidine
CID 113305641
[6-(2-methyl-5-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 54909715
N-[1-[6-(2-fluoro-3-methylphenoxy)-3-pyridinyl]ethyl]propan-1-amine
CID 107658828

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol (CID 102989853) is (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol is Cc1ccc(F)cc1Oc1ccc([C@H](C)O)cn1.
What is the InChIKey of (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol?
The InChIKey is ORPYODDMUILQCO-JTQLQIEISA-N. The full InChI is InChI=1S/C14H14FNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3/t10-/m0/s1.
What are the key properties of (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol?
(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol has a molecular weight of 247.27 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol is sourced from PubChem (CID 102989853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).