6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid

C12H7F2NO3 — CID 55053506

IUPAC6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C12H7F2NO3/c13-7-4-5-10(8(14)6-7)18-11-3-1-2-9(15-11)12(16)17/h1-6H,(H,16,17)
InChIKeyJOYDRANXSACUHQ-UHFFFAOYSA-N
MW251.19 g/mol
LogP2.85
Rot. Bonds3

About 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid

6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid (PubChem CID 55053506) has the molecular formula C12H7F2NO3 and a molecular weight of 251.19 g/mol. Its IUPAC name is 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
PubChem CID55053506
Molecular FormulaC12H7F2NO3
Molecular Weight251.19 g/mol
Exact Mass251.04
IUPAC Name6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C12H7F2NO3/c13-7-4-5-10(8(14)6-7)18-11-3-1-2-9(15-11)12(16)17/h1-6H,(H,16,17)
InChIKeyJOYDRANXSACUHQ-UHFFFAOYSA-N
XLogP2.85
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.19
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-bromo-2-chloro-5-fluorophenoxy)pyridine-2-carboxylic acid
CID 114270905
6-(2,6-dimethoxyphenoxy)pyridine-2-carboxylic acid
CID 62255155
4-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
CID 43325985
2-benzylsulfanyl-6-(2,4-difluorophenoxy)pyridine
CID 91585755
6-[4-[[3-[(4-chlorophenyl)methyl]-1-ethyl-2,6-dioxopyrimidin-4-yl]amino]-2-fluorophenoxy]pyridine-2-carboxylic acid
CID 71728269
6-[3-(trifluoromethyl)phenoxy]pyridine-2-carboxylic acid
CID 4271775
2-(2,4-difluorophenoxy)-4,8-dimethylquinoline
CID 3838364
6-(2-chloro-4-fluorophenoxy)pyrimidine-4-carboxylic acid
CID 116820278
6-[[(2,4-difluorophenyl)methylamino]methyl]pyridine-2-carboxylic acid
CID 106904640
4-fluorophenol;6-(4-fluorophenoxy)pyridine-2-carboxylic acid;methyl 6-bromopyridine-2-carboxylate
CID 160520236
6-[[6-(2,6-difluoro-3-pyridinyl)-2-pyridinyl]oxy]pyridine-2-carboxylic acid
CID 59399092
6-(3-fluorophenyl)pyridine-2-carboxylic acid
CID 24730139

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid?
The IUPAC name of 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid (CID 55053506) is 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid is O=C(O)c1cccc(Oc2ccc(F)cc2F)n1.
What is the InChIKey of 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid?
The InChIKey is JOYDRANXSACUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2NO3/c13-7-4-5-10(8(14)6-7)18-11-3-1-2-9(15-11)12(16)17/h1-6H,(H,16,17).
What are the key properties of 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid?
6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid has a molecular weight of 251.19 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenoxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 55053506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).