4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid

C12H9NO4 — CID 69017649

IUPAC4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(Oc2ccc(O)cc2)ccn1
InChIInChI=1S/C12H9NO4/c14-8-1-3-9(4-2-8)17-10-5-6-13-11(7-10)12(15)16/h1-7,14H,(H,15,16)
InChIKeyJKGZQICUPVGHNH-UHFFFAOYSA-N
MW231.21 g/mol
LogP2.28
Rot. Bonds3

About 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid

4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid (PubChem CID 69017649) has the molecular formula C12H9NO4 and a molecular weight of 231.21 g/mol. Its IUPAC name is 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid
PubChem CID69017649
Molecular FormulaC12H9NO4
Molecular Weight231.21 g/mol
Exact Mass231.05
IUPAC Name4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid
SMILESO=C(O)c1cc(Oc2ccc(O)cc2)ccn1
InChIInChI=1S/C12H9NO4/c14-8-1-3-9(4-2-8)17-10-5-6-13-11(7-10)12(15)16/h1-7,14H,(H,15,16)
InChIKeyJKGZQICUPVGHNH-UHFFFAOYSA-N
XLogP2.28
TPSA79.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.21
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-cyanophenoxy)pyridine-2-carboxylic acid
CID 43142929
4-(2,3-dihydro-1H-inden-5-yloxy)pyridine-2-carboxylic acid
CID 43326034
4-(4-imidazol-1-ylphenoxy)pyridine-2-carboxylic acid
CID 67405266
4-[4-[4-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]phenoxy]pyridine-2-carboxylic acid
CID 140746647
4-[4-[(4-hydroxyphenyl)diazenyl]phenoxy]-N-methylpyridine-2-carboxamide
CID 165438064
4-[4-fluoro-3-(trifluoromethyl)phenoxy]pyridine-2-carboxylic acid
CID 102747015
4-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
CID 43325985
4-(3-chloro-4-nitrophenoxy)pyridine-2-carboxylic acid
CID 62111596
4-(3-ethylphenoxy)pyridine-2-carboxylic acid
CID 43326028
4-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]pyridine-2-carboxylic acid
CID 43325986
4-(2,5-dichlorophenoxy)pyridine-2-carboxylic acid
CID 43325991
5-[(2-carbamoyl-4-pyridinyl)oxy]-2-chlorobenzoic acid
CID 106502994

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid?
The IUPAC name of 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid (CID 69017649) is 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid is O=C(O)c1cc(Oc2ccc(O)cc2)ccn1.
What is the InChIKey of 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid?
The InChIKey is JKGZQICUPVGHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO4/c14-8-1-3-9(4-2-8)17-10-5-6-13-11(7-10)12(15)16/h1-7,14H,(H,15,16).
What are the key properties of 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid?
4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid has a molecular weight of 231.21 g/mol, XLogP of 2.28, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 69017649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).