(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol

C14H14FNO2 — CID 107659141

IUPAC(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol
SMILESCc1cccc(Oc2cc([C@@H](C)O)ccn2)c1F
InChIInChI=1S/C14H14FNO2/c1-9-4-3-5-12(14(9)15)18-13-8-11(10(2)17)6-7-16-13/h3-8,10,17H,1-2H3/t10-/m1/s1
InChIKeyZAFMZZONAUIMEO-SNVBAGLBSA-N
MW247.27 g/mol
LogP3.37
Rot. Bonds3

About (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol

(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol (PubChem CID 107659141) has the molecular formula C14H14FNO2 and a molecular weight of 247.27 g/mol. Its IUPAC name is (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol
PubChem CID107659141
Molecular FormulaC14H14FNO2
Molecular Weight247.27 g/mol
Exact Mass247.10
IUPAC Name(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol
SMILESCc1cccc(Oc2cc([C@@H](C)O)ccn2)c1F
InChIInChI=1S/C14H14FNO2/c1-9-4-3-5-12(14(9)15)18-13-8-11(10(2)17)6-7-16-13/h3-8,10,17H,1-2H3/t10-/m1/s1
InChIKeyZAFMZZONAUIMEO-SNVBAGLBSA-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

(1S)-1-[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]ethanol
CID 104892705
(1R)-1-[3-fluoro-4-(2-fluoro-3-methylphenoxy)phenyl]ethanol
CID 107659139
1-[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]ethanamine
CID 116689319
1-[2-(3-bromo-4-fluorophenoxy)-4-pyridinyl]ethanol
CID 83234966
(1R)-1-[2-(3-bromo-4-fluorophenoxy)-4-pyridinyl]ethanol
CID 83234050
(1R)-1-[2-(3-bromo-5-fluorophenoxy)-4-pyridinyl]ethanol
CID 81331652
(1S)-1-[2-(3-bromo-4-fluorophenoxy)-4-pyridinyl]ethanol
CID 83234137
1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol
CID 107659175
(1S)-1-[2-(4-butan-2-ylphenoxy)-4-pyridinyl]ethanol
CID 107665917
1-[2-(4-butylphenoxy)-4-pyridinyl]ethanol
CID 115492831
1-(2-methyl-4-pyridinyl)ethanol
CID 106756390
(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol
CID 102989853

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol (CID 107659141) is (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol is Cc1cccc(Oc2cc([C@@H](C)O)ccn2)c1F.
What is the InChIKey of (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol?
The InChIKey is ZAFMZZONAUIMEO-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H14FNO2/c1-9-4-3-5-12(14(9)15)18-13-8-11(10(2)17)6-7-16-13/h3-8,10,17H,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol?
(1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-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 (1R)-1-[2-(2-fluoro-3-methylphenoxy)-4-pyridinyl]ethanol is sourced from PubChem (CID 107659141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).