5-amino-6-ethoxypyridine-3-carboxylic acid

C8H10N2O3 — CID 81439997

IUPAC5-amino-6-ethoxypyridine-3-carboxylic acid
SMILESCCOc1ncc(C(=O)O)cc1N
InChIInChI=1S/C8H10N2O3/c1-2-13-7-6(9)3-5(4-10-7)8(11)12/h3-4H,2,9H2,1H3,(H,11,12)
InChIKeyFFXJVECKGAXZGO-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.76
Rot. Bonds3

About 5-amino-6-ethoxypyridine-3-carboxylic acid

5-amino-6-ethoxypyridine-3-carboxylic acid (PubChem CID 81439997) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 5-amino-6-ethoxypyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-amino-6-ethoxypyridine-3-carboxylic acid
PubChem CID81439997
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name5-amino-6-ethoxypyridine-3-carboxylic acid
SMILESCCOc1ncc(C(=O)O)cc1N
InChIInChI=1S/C8H10N2O3/c1-2-13-7-6(9)3-5(4-10-7)8(11)12/h3-4H,2,9H2,1H3,(H,11,12)
InChIKeyFFXJVECKGAXZGO-UHFFFAOYSA-N
XLogP0.76
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-6-ethoxypyridine-3-carboxylic acid
CID 66835474
5-amino-6-[(2-fluorophenyl)methoxy]pyridine-3-carboxylic acid
CID 81439627
5,6-diaminopyridine-3-carboxylic acid
CID 22476298
5-amino-6-(2,3,6-trimethylphenoxy)pyridine-3-carboxylic acid
CID 81439064
5-amino-6-(2,5-dibromo-4-methoxyphenoxy)pyridine-3-carboxylic acid
CID 81447618
5-amino-6-(2-iodophenoxy)pyridine-3-carboxylic acid
CID 81439625
5-amino-6-(3,5-difluorophenoxy)pyridine-3-carboxylic acid
CID 81438869
5-amino-6-[(2-methyl-3-pyridinyl)oxy]pyridine-3-carboxylic acid
CID 81439910
5-amino-6-(4-propan-2-ylphenoxy)pyridine-3-carboxylic acid
CID 81438860
5-amino-6-(2,4-dichlorophenoxy)pyridine-3-carboxylic acid
CID 81439243
6-amino-5-ethoxycarbonylpyridine-3-carboxylic acid
CID 170903103
5-amino-6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carboxylic acid
CID 81447219

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-ethoxypyridine-3-carboxylic acid?
The IUPAC name of 5-amino-6-ethoxypyridine-3-carboxylic acid (CID 81439997) is 5-amino-6-ethoxypyridine-3-carboxylic acid.
What is the SMILES notation for 5-amino-6-ethoxypyridine-3-carboxylic acid?
The canonical SMILES for 5-amino-6-ethoxypyridine-3-carboxylic acid is CCOc1ncc(C(=O)O)cc1N.
What is the InChIKey of 5-amino-6-ethoxypyridine-3-carboxylic acid?
The InChIKey is FFXJVECKGAXZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-2-13-7-6(9)3-5(4-10-7)8(11)12/h3-4H,2,9H2,1H3,(H,11,12).
What are the key properties of 5-amino-6-ethoxypyridine-3-carboxylic acid?
5-amino-6-ethoxypyridine-3-carboxylic acid has a molecular weight of 182.18 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-ethoxypyridine-3-carboxylic acid is sourced from PubChem (CID 81439997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).