2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid

C15H14FNO3 — CID 142793839

IUPAC2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid
SMILESCC(C(=O)O)c1ccccc1OCc1ccc(F)cn1
InChIInChI=1S/C15H14FNO3/c1-10(15(18)19)13-4-2-3-5-14(13)20-9-12-7-6-11(16)8-17-12/h2-8,10H,9H2,1H3,(H,18,19)
InChIKeyYQVRZAFOCRNSNK-UHFFFAOYSA-N
MW275.28 g/mol
LogP2.99
Rot. Bonds5

About 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid

2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid (PubChem CID 142793839) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid.

Molecular Properties

Compound Name2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid
PubChem CID142793839
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC Name2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid
SMILESCC(C(=O)O)c1ccccc1OCc1ccc(F)cn1
InChIInChI=1S/C15H14FNO3/c1-10(15(18)19)13-4-2-3-5-14(13)20-9-12-7-6-11(16)8-17-12/h2-8,10H,9H2,1H3,(H,18,19)
InChIKeyYQVRZAFOCRNSNK-UHFFFAOYSA-N
XLogP2.99
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2-phenylmethoxyphenyl)propanoic acid
CID 129363475
2-[2-[[2-(2-methoxyphenyl)pyrimidin-4-yl]methoxy]phenyl]propanoic acid
CID 154247950
5-fluoro-2-[(2-fluorophenoxy)methyl]pyridine
CID 123573054
2-[2-[(6-methoxy-2-phenylpyrimidin-4-yl)methoxy]phenyl]propanoic acid
CID 142793840
2-[2-[[2-[4-(hydroxymethyl)phenyl]pyrimidin-4-yl]methoxy]phenyl]propanoic acid
CID 167428797
2-[(2-propan-2-ylphenoxy)methyl]pyrimidine-5-carboxylic acid
CID 82168708
2-(5-fluoro-2-methoxyphenyl)propanoic acid
CID 79002336
methyl 2-(2-phenylmethoxyphenyl)propanoate
CID 54327103
2-[(2-propan-2-ylphenoxy)methyl]benzoic acid
CID 20987862
(2-ethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 79721579
2-[1-[(2-methoxyphenyl)methyl]isoquinolin-4-yl]propanoic acid
CID 67425908
(1S)-1-[2-(pyrimidin-2-ylmethoxy)phenyl]ethanol
CID 78931636

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid?
The IUPAC name of 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid (CID 142793839) is 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid.
What is the SMILES notation for 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid?
The canonical SMILES for 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid is CC(C(=O)O)c1ccccc1OCc1ccc(F)cn1.
What is the InChIKey of 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid?
The InChIKey is YQVRZAFOCRNSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-10(15(18)19)13-4-2-3-5-14(13)20-9-12-7-6-11(16)8-17-12/h2-8,10H,9H2,1H3,(H,18,19).
What are the key properties of 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid?
2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid has a molecular weight of 275.28 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(5-fluoro-2-pyridinyl)methoxy]phenyl]propanoic acid is sourced from PubChem (CID 142793839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).