6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid

C11H15NO4 — CID 103487111

IUPAC6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid
SMILESCCOCC(C)Oc1cccc(C(=O)O)n1
InChIInChI=1S/C11H15NO4/c1-3-15-7-8(2)16-10-6-4-5-9(12-10)11(13)14/h4-6,8H,3,7H2,1-2H3,(H,13,14)
InChIKeyWLITXQGJEVYFAB-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.58
Rot. Bonds6

About 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid

6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid (PubChem CID 103487111) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid
PubChem CID103487111
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid
SMILESCCOCC(C)Oc1cccc(C(=O)O)n1
InChIInChI=1S/C11H15NO4/c1-3-15-7-8(2)16-10-6-4-5-9(12-10)11(13)14/h4-6,8H,3,7H2,1-2H3,(H,13,14)
InChIKeyWLITXQGJEVYFAB-UHFFFAOYSA-N
XLogP1.58
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(1-ethoxypropan-2-yloxy)pyridazine-3-carboxylic acid
CID 103487109
6-(1-ethoxypropan-2-ylamino)pyridine-2-carboxylic acid
CID 62240918
6-(2-aminopropoxy)pyridine-2-carboxylic acid
CID 154848823
2-(1-ethoxypropan-2-yloxy)-3-fluorobenzoic acid
CID 103487194
6-butan-2-yloxypyridine-2-carbothioamide
CID 64594535
6-(trideuteriomethoxy)pyridine-2-carboxylic acid
CID 155291992
2-(1-ethoxypropan-2-yloxy)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 103487173
3-bromo-4-(1-ethoxypropan-2-yloxy)benzoic acid
CID 103490829
6-(4-propan-2-ylphenoxy)pyridine-2-carboxylic acid
CID 62253003
ethyl 6-(2-aminopropoxy)pyridine-2-carboxylate
CID 155937838
6-cyclopropyloxypyridine-2-carboxylic acid
CID 146463026
2-chloro-6-(1-ethoxypropan-2-yloxy)pyrazine
CID 103488018

Frequently Asked Questions

What is the IUPAC name of 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid?
The IUPAC name of 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid (CID 103487111) is 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid is CCOCC(C)Oc1cccc(C(=O)O)n1.
What is the InChIKey of 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid?
The InChIKey is WLITXQGJEVYFAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-3-15-7-8(2)16-10-6-4-5-9(12-10)11(13)14/h4-6,8H,3,7H2,1-2H3,(H,13,14).
What are the key properties of 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid?
6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid has a molecular weight of 225.24 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-ethoxypropan-2-yloxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 103487111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).