(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol

C13H12FNO2 — CID 114059302

IUPAC(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol
SMILESC[C@@H](O)c1cccc(F)c1Oc1cccnc1
InChIInChI=1S/C13H12FNO2/c1-9(16)11-5-2-6-12(14)13(11)17-10-4-3-7-15-8-10/h2-9,16H,1H3/t9-/m1/s1
InChIKeyJNZNWBLLAWQALC-SECBINFHSA-N
MW233.24 g/mol
LogP3.07
Rot. Bonds3

About (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol

(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol (PubChem CID 114059302) has the molecular formula C13H12FNO2 and a molecular weight of 233.24 g/mol. Its IUPAC name is (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol
PubChem CID114059302
Molecular FormulaC13H12FNO2
Molecular Weight233.24 g/mol
Exact Mass233.09
IUPAC Name(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol
SMILESC[C@@H](O)c1cccc(F)c1Oc1cccnc1
InChIInChI=1S/C13H12FNO2/c1-9(16)11-5-2-6-12(14)13(11)17-10-4-3-7-15-8-10/h2-9,16H,1H3/t9-/m1/s1
InChIKeyJNZNWBLLAWQALC-SECBINFHSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[3-fluoro-2-(3-iodophenoxy)phenyl]ethanol
CID 114059300
(1S)-1-[3-fluoro-2-(2-methylphenoxy)phenyl]ethanol
CID 114059293
(1S)-1-isoquinolin-5-ylethanol
CID 94831084
1-(2-fluorophenyl)-2-pyridin-3-yloxyethanol
CID 117243776
(1S)-1-[2-fluoro-4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 107720608
3-chloro-5-(2,6-difluorophenoxy)pyridine
CID 141409360
(1S)-1-(3-bromo-4-pyridin-3-yloxyphenyl)ethanol
CID 78941748
(1R)-1-[2-(3,4-difluorophenoxy)-3-pyridinyl]ethanol
CID 114056480
(1R)-1-quinolin-5-ylethanol
CID 86326294
3,3-difluoro-4-[(1S)-1-hydroxyethyl]-1-(pyridin-3-ylmethyl)indol-2-one
CID 121361922
3,5-difluoro-4-pyridin-3-yloxybenzenecarboximidamide
CID 81293654
2,6-dipyridin-3-yloxyphenol
CID 139940524

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol?
The IUPAC name of (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol (CID 114059302) is (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol.
What is the SMILES notation for (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol?
The canonical SMILES for (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol is C[C@@H](O)c1cccc(F)c1Oc1cccnc1.
What is the InChIKey of (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol?
The InChIKey is JNZNWBLLAWQALC-SECBINFHSA-N. The full InChI is InChI=1S/C13H12FNO2/c1-9(16)11-5-2-6-12(14)13(11)17-10-4-3-7-15-8-10/h2-9,16H,1H3/t9-/m1/s1.
What are the key properties of (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol?
(1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol has a molecular weight of 233.24 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-fluoro-2-pyridin-3-yloxyphenyl)ethanol is sourced from PubChem (CID 114059302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).