5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid

C11H8ClN3O3 — CID 114409020

IUPAC5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid
SMILESNc1ccc(C(=O)O)nc1Oc1cncc(Cl)c1
InChIInChI=1S/C11H8ClN3O3/c12-6-3-7(5-14-4-6)18-10-8(13)1-2-9(15-10)11(16)17/h1-5H,13H2,(H,16,17)
InChIKeyKEZQOWHKQHBNOC-UHFFFAOYSA-N
MW265.66 g/mol
LogP2.20
Rot. Bonds3

About 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid

5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid (PubChem CID 114409020) has the molecular formula C11H8ClN3O3 and a molecular weight of 265.66 g/mol. Its IUPAC name is 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid
PubChem CID114409020
Molecular FormulaC11H8ClN3O3
Molecular Weight265.66 g/mol
Exact Mass265.03
IUPAC Name5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid
SMILESNc1ccc(C(=O)O)nc1Oc1cncc(Cl)c1
InChIInChI=1S/C11H8ClN3O3/c12-6-3-7(5-14-4-6)18-10-8(13)1-2-9(15-10)11(16)17/h1-5H,13H2,(H,16,17)
InChIKeyKEZQOWHKQHBNOC-UHFFFAOYSA-N
XLogP2.20
TPSA98.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.66
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-2-[(5-chloro-3-pyridinyl)oxy]pyridin-3-amine
CID 115474542
1-[(5-chloro-3-pyridinyl)oxy]isoquinoline-3-carboxylic acid
CID 64600585
5-amino-6-(3-ethoxyphenoxy)pyridine-2-carboxylic acid
CID 114408919
methyl 5-amino-6-[(5-bromo-3-pyridinyl)oxy]pyridine-2-carboxylate
CID 114409015
6-[(5-chloro-3-pyridinyl)oxy]-2-methoxypyridin-3-amine
CID 64602121
5-amino-6-[4-(2-hydroxyethyl)phenoxy]pyridine-2-carboxylic acid
CID 107709763
5-amino-3-chloro-2-[(5-chloro-3-pyridinyl)oxy]benzoic acid
CID 107197944
5-amino-6-[3-(dimethylamino)phenoxy]pyridine-2-carboxylic acid
CID 114408858
2-chloro-4-[(5-chloro-3-pyridinyl)oxy]aniline
CID 22148760
1-[(5-chloro-3-pyridinyl)oxy]isoquinoline-4-carboxylic acid
CID 106765808
6-[(5-chloro-3-pyridinyl)oxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 64602505
2-[(5-chloro-3-pyridinyl)oxy]-6-methylpyridine-4-carboxylic acid
CID 113378263

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid?
The IUPAC name of 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid (CID 114409020) is 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid?
The canonical SMILES for 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid is Nc1ccc(C(=O)O)nc1Oc1cncc(Cl)c1.
What is the InChIKey of 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid?
The InChIKey is KEZQOWHKQHBNOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN3O3/c12-6-3-7(5-14-4-6)18-10-8(13)1-2-9(15-10)11(16)17/h1-5H,13H2,(H,16,17).
What are the key properties of 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid?
5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid has a molecular weight of 265.66 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-[(5-chloro-3-pyridinyl)oxy]pyridine-2-carboxylic acid is sourced from PubChem (CID 114409020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).