3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid

C11H7FN2O3 — CID 81442880

IUPAC3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid
SMILESO=C(O)c1ccncc1Oc1ncccc1F
InChIInChI=1S/C11H7FN2O3/c12-8-2-1-4-14-10(8)17-9-6-13-5-3-7(9)11(15)16/h1-6H,(H,15,16)
InChIKeyHWYIMHVVLIBMRA-UHFFFAOYSA-N
MW234.19 g/mol
LogP2.11
Rot. Bonds3

About 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid

3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid (PubChem CID 81442880) has the molecular formula C11H7FN2O3 and a molecular weight of 234.19 g/mol. Its IUPAC name is 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid
PubChem CID81442880
Molecular FormulaC11H7FN2O3
Molecular Weight234.19 g/mol
Exact Mass234.04
IUPAC Name3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid
SMILESO=C(O)c1ccncc1Oc1ncccc1F
InChIInChI=1S/C11H7FN2O3/c12-8-2-1-4-14-10(8)17-9-6-13-5-3-7(9)11(15)16/h1-6H,(H,15,16)
InChIKeyHWYIMHVVLIBMRA-UHFFFAOYSA-N
XLogP2.11
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-carbamoyl-2-pyridinyl)oxy]pyridine-4-carboxylic acid
CID 81443048
3-[(3-fluoro-2-pyridinyl)methoxy]pyridine-4-carboxylic acid
CID 175485081
5-chloro-2-[(3-fluoro-2-pyridinyl)oxy]benzoic acid
CID 62733253
3-furo[3,2-c]pyridin-4-yloxypyridine-4-carboxylic acid
CID 106535499
3-(3-fluoropropoxy)pyridine-4-carboxylic acid
CID 81446128
3-(4-chlorophenoxy)pyridine-4-carboxylic acid
CID 114288873
3-chloro-4-[(3-fluoro-2-pyridinyl)oxy]benzoic acid
CID 62733254
3-(2-bromophenoxy)pyridine-4-carboxylic acid
CID 114288896
3-(4-chloro-2-methylphenoxy)pyridine-4-carboxylic acid
CID 114288885
3-(4-carbamoyl-3-fluorophenoxy)pyridine-4-carboxylic acid
CID 105062510
2-(2-carbamoyl-3-fluorophenoxy)pyridine-3-carboxylic acid
CID 43609549
3-(3-oxo-4-propylpyrazin-2-yl)oxypyridine-4-carboxylic acid
CID 81443631

Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid?
The IUPAC name of 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid (CID 81442880) is 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid.
What is the SMILES notation for 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid?
The canonical SMILES for 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid is O=C(O)c1ccncc1Oc1ncccc1F.
What is the InChIKey of 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid?
The InChIKey is HWYIMHVVLIBMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN2O3/c12-8-2-1-4-14-10(8)17-9-6-13-5-3-7(9)11(15)16/h1-6H,(H,15,16).
What are the key properties of 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid?
3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid has a molecular weight of 234.19 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluoro-2-pyridinyl)oxy]pyridine-4-carboxylic acid is sourced from PubChem (CID 81442880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).