2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid

C13H10FNO3 — CID 46315689

IUPAC2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1cccc(F)c1-c1cccnc1
InChIInChI=1S/C13H10FNO3/c14-10-5-1-4-9(12(16)13(17)18)11(10)8-3-2-6-15-7-8/h1-7,12,16H,(H,17,18)
InChIKeyFLTOIRQXHUJSJH-UHFFFAOYSA-N
MW247.23 g/mol
LogP2.01
Rot. Bonds3

About 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid

2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid (PubChem CID 46315689) has the molecular formula C13H10FNO3 and a molecular weight of 247.23 g/mol. Its IUPAC name is 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid.

Molecular Properties

Compound Name2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid
PubChem CID46315689
Molecular FormulaC13H10FNO3
Molecular Weight247.23 g/mol
Exact Mass247.06
IUPAC Name2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid
SMILESO=C(O)C(O)c1cccc(F)c1-c1cccnc1
InChIInChI=1S/C13H10FNO3/c14-10-5-1-4-9(12(16)13(17)18)11(10)8-3-2-6-15-7-8/h1-7,12,16H,(H,17,18)
InChIKeyFLTOIRQXHUJSJH-UHFFFAOYSA-N
XLogP2.01
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.23
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluoro-2-pyridin-3-ylphenyl)acetic acid
CID 46315774
2-(3-fluoro-4-pyridinyl)-2-hydroxyacetic acid
CID 104737624
2-fluoro-6-pyridin-3-ylbenzoic acid
CID 46315544
3-methyl-2-pyridin-3-ylbenzoic acid
CID 46317094
(2S)-2-amino-2-(2-pyridin-3-ylphenyl)acetic acid
CID 66512915
2-[2-(dimethylamino)-3-fluorophenyl]-2-hydroxyacetic acid
CID 117108572
2-[3-fluoro-2-(2-fluoropropan-2-yl)phenyl]-2-hydroxyacetic acid
CID 117332015
N-tert-butyl-3-fluoro-2-pyridin-3-ylbenzenesulfonamide
CID 175711692
2-fluoro-4-methyl-3-pyridin-3-ylbenzamide
CID 155144897
2-[2-fluoro-5-(3-fluorophenyl)phenyl]-2-hydroxyacetic acid
CID 46312557
2-[2-fluoro-3-(3-fluorophenyl)phenyl]-2-hydroxyacetic acid
CID 46312542
2-(2-fluoro-5-pyridin-3-ylphenyl)acetic acid
CID 46315790

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid?
The IUPAC name of 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid (CID 46315689) is 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid.
What is the SMILES notation for 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid?
The canonical SMILES for 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid is O=C(O)C(O)c1cccc(F)c1-c1cccnc1.
What is the InChIKey of 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid?
The InChIKey is FLTOIRQXHUJSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO3/c14-10-5-1-4-9(12(16)13(17)18)11(10)8-3-2-6-15-7-8/h1-7,12,16H,(H,17,18).
What are the key properties of 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid?
2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid has a molecular weight of 247.23 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-2-pyridin-3-ylphenyl)-2-hydroxyacetic acid is sourced from PubChem (CID 46315689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).