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

C14H13NO4 — CID 43142917

IUPAC4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid
SMILESCCOc1ccccc1Oc1ccnc(C(=O)O)c1
InChIInChI=1S/C14H13NO4/c1-2-18-12-5-3-4-6-13(12)19-10-7-8-15-11(9-10)14(16)17/h3-9H,2H2,1H3,(H,16,17)
InChIKeyKFIVHAVPFRUMGT-UHFFFAOYSA-N
MW259.26 g/mol
LogP2.97
Rot. Bonds5

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

4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid (PubChem CID 43142917) has the molecular formula C14H13NO4 and a molecular weight of 259.26 g/mol. Its IUPAC name is 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid
PubChem CID43142917
Molecular FormulaC14H13NO4
Molecular Weight259.26 g/mol
Exact Mass259.08
IUPAC Name4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid
SMILESCCOc1ccccc1Oc1ccnc(C(=O)O)c1
InChIInChI=1S/C14H13NO4/c1-2-18-12-5-3-4-6-13(12)19-10-7-8-15-11(9-10)14(16)17/h3-9H,2H2,1H3,(H,16,17)
InChIKeyKFIVHAVPFRUMGT-UHFFFAOYSA-N
XLogP2.97
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-butan-2-ylphenoxy)pyridine-2-carboxylic acid
CID 43326012
4-(2-ethoxyphenoxy)pyridine-2-carboximidamide
CID 62926158
4-(2-acetamidophenoxy)pyridine-2-carboxylic acid
CID 43142934
[4-(2-ethoxyphenoxy)-2-pyridinyl]methanamine
CID 62298325
4-(3-ethylphenoxy)pyridine-2-carboxylic acid
CID 43326028
4-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
CID 43325985
4-decoxypyridine-2-carboxylic acid
CID 152529644
4-(3-methyl-2-nitrophenoxy)pyridine-2-carboxylic acid
CID 61037967
4-butan-2-yloxypyridine-2-carboxylic acid
CID 60903768
4-(2,5-dichlorophenoxy)pyridine-2-carboxylic acid
CID 43325991
4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid
CID 43325992
4-(4-hydroxyphenoxy)pyridine-2-carboxylic acid
CID 69017649

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid?
The IUPAC name of 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid (CID 43142917) is 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid is CCOc1ccccc1Oc1ccnc(C(=O)O)c1.
What is the InChIKey of 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid?
The InChIKey is KFIVHAVPFRUMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO4/c1-2-18-12-5-3-4-6-13(12)19-10-7-8-15-11(9-10)14(16)17/h3-9H,2H2,1H3,(H,16,17).
What are the key properties of 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid?
4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid has a molecular weight of 259.26 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 43142917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).