2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid

C14H12FNO3 — CID 107656799

IUPAC2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(Oc2cccc(C)c2F)n1
InChIInChI=1S/C14H12FNO3/c1-8-4-3-5-11(13(8)15)19-12-7-10(14(17)18)6-9(2)16-12/h3-7H,1-2H3,(H,17,18)
InChIKeyRVPXDQAABMBACK-UHFFFAOYSA-N
MW261.25 g/mol
LogP3.33
Rot. Bonds3

About 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid

2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid (PubChem CID 107656799) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid
PubChem CID107656799
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC Name2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(Oc2cccc(C)c2F)n1
InChIInChI=1S/C14H12FNO3/c1-8-4-3-5-11(13(8)15)19-12-7-10(14(17)18)6-9(2)16-12/h3-7H,1-2H3,(H,17,18)
InChIKeyRVPXDQAABMBACK-UHFFFAOYSA-N
XLogP3.33
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-5-fluorophenoxy)-6-methylpyridine-4-carboxylic acid
CID 114264226
2-(5-bromo-2-methylphenoxy)-6-methylpyridine-4-carboxylic acid
CID 107283603
3-bromo-4-(2-fluoro-3-methylphenoxy)benzoic acid
CID 107661525
2-methoxy-6-methylpyridine-4-carboxylic acid;hydrochloride
CID 112756430
6-(2-fluoro-3-methylphenoxy)-5-nitropyridine-2-carboxylic acid
CID 107656824
6-(2-fluoro-3-methylphenoxy)-2-(trifluoromethyl)pyrimidin-4-amine
CID 107662740
2-methyl-6-(1-phenylethoxy)pyridine-4-carboxylic acid
CID 113378245
6-(2-fluoro-3-methylphenoxy)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 107662702
1-[3-(2-fluoro-3-methylphenoxy)phenyl]ethanone
CID 107658623
4-chloro-6-(2-fluoro-3-methylphenoxy)-2-propylpyrimidine
CID 107657898
3-(2-fluoro-3-methylphenoxy)pyridazine-4-carboxylic acid
CID 107661523
4-amino-2-(2-fluoro-3-methylphenoxy)benzoic acid
CID 107660000

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid?
The IUPAC name of 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid (CID 107656799) is 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid?
The canonical SMILES for 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid is Cc1cc(C(=O)O)cc(Oc2cccc(C)c2F)n1.
What is the InChIKey of 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid?
The InChIKey is RVPXDQAABMBACK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-8-4-3-5-11(13(8)15)19-12-7-10(14(17)18)6-9(2)16-12/h3-7H,1-2H3,(H,17,18).
What are the key properties of 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid?
2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid has a molecular weight of 261.25 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methylphenoxy)-6-methylpyridine-4-carboxylic acid is sourced from PubChem (CID 107656799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).