2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid

C14H12FNO3 — CID 64856053

IUPAC2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid
SMILESCc1ccc(F)c(Oc2nc(C)ccc2C(=O)O)c1
InChIInChI=1S/C14H12FNO3/c1-8-3-6-11(15)12(7-8)19-13-10(14(17)18)5-4-9(2)16-13/h3-7H,1-2H3,(H,17,18)
InChIKeyGYNOTTMTXQEGOK-UHFFFAOYSA-N
MW261.25 g/mol
LogP3.33
Rot. Bonds3

About 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid

2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid (PubChem CID 64856053) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid
PubChem CID64856053
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC Name2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid
SMILESCc1ccc(F)c(Oc2nc(C)ccc2C(=O)O)c1
InChIInChI=1S/C14H12FNO3/c1-8-3-6-11(15)12(7-8)19-13-10(14(17)18)5-4-9(2)16-13/h3-7H,1-2H3,(H,17,18)
InChIKeyGYNOTTMTXQEGOK-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-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboximidamide
CID 64855988
2-(3,5-difluorophenoxy)-6-methylpyridine-3-carboxylic acid
CID 62783634
2-bromo-4-(2-fluoro-5-methylphenoxy)benzoic acid
CID 107282560
[2-(2-fluoro-5-methylphenoxy)-6-methyl-3-pyridinyl]methanamine
CID 64853407
2-(2,5-dibromo-4-methoxyphenoxy)-6-methylpyridine-3-carboxylic acid
CID 79407873
6-chloro-2-(2-chloro-5-methylphenoxy)pyridine-3-carboxylic acid
CID 55183255
2-methoxy-6-methylpyridine-3-carboxylic acid
CID 22494228
2-(2,5-difluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 63268704
2-(2-fluoro-5-methylphenoxy)-4-nitrobenzoic acid
CID 64855000
2-(3,4-dichlorophenoxy)-6-methylpyridine-3-carboxylic acid
CID 62703441
2-(2,3-dichlorophenoxy)-6-methylpyridine-3-carboxylic acid
CID 55107905
[2-(2-fluoro-5-methylphenoxy)-4,6-dimethyl-3-pyridinyl]methanamine
CID 64853800

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid?
The IUPAC name of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid (CID 64856053) is 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid?
The canonical SMILES for 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid is Cc1ccc(F)c(Oc2nc(C)ccc2C(=O)O)c1.
What is the InChIKey of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid?
The InChIKey is GYNOTTMTXQEGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-8-3-6-11(15)12(7-8)19-13-10(14(17)18)5-4-9(2)16-13/h3-7H,1-2H3,(H,17,18).
What are the key properties of 2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid?
2-(2-fluoro-5-methylphenoxy)-6-methylpyridine-3-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-5-methylphenoxy)-6-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 64856053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).