5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid

C15H14ClNO4 — CID 107664153

IUPAC5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid
SMILESCCc1ccc(Oc2ncc(C(=O)O)cc2Cl)c(OC)c1
InChIInChI=1S/C15H14ClNO4/c1-3-9-4-5-12(13(6-9)20-2)21-14-11(16)7-10(8-17-14)15(18)19/h4-8H,3H2,1-2H3,(H,18,19)
InChIKeyNMGSVFSLRCLOGX-UHFFFAOYSA-N
MW307.73 g/mol
LogP3.80
Rot. Bonds5

About 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid

5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid (PubChem CID 107664153) has the molecular formula C15H14ClNO4 and a molecular weight of 307.73 g/mol. Its IUPAC name is 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid
PubChem CID107664153
Molecular FormulaC15H14ClNO4
Molecular Weight307.73 g/mol
Exact Mass307.06
IUPAC Name5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid
SMILESCCc1ccc(Oc2ncc(C(=O)O)cc2Cl)c(OC)c1
InChIInChI=1S/C15H14ClNO4/c1-3-9-4-5-12(13(6-9)20-2)21-14-11(16)7-10(8-17-14)15(18)19/h4-8H,3H2,1-2H3,(H,18,19)
InChIKeyNMGSVFSLRCLOGX-UHFFFAOYSA-N
XLogP3.80
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.73
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid
CID 107664132
4-[(4-ethyl-2-methoxyphenoxy)methyl]benzoic acid
CID 104637822
3-bromo-5-chloro-2-(4-ethyl-2-methoxyphenoxy)pyridine
CID 107667632
5-chloro-6-(4-methoxyphenoxy)pyridine-3-carboxylic acid
CID 16784776
2-(4-ethyl-2-methoxyphenoxy)-6-methylpyridine-3-carboxylic acid
CID 107668753
5-chloro-6-(2-chloro-5-methylphenoxy)pyridine-3-carboxylic acid
CID 43364384
5,6-dimethoxypyridine-3-carboxylic acid
CID 12563086
5-chloro-6-(2,5-dimethylphenoxy)pyridine-3-carboxylic acid
CID 28605623
2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-3-amine
CID 107663853
6-(4-butan-2-ylphenoxy)-5-chloropyridine-3-carboxylic acid
CID 107664122
1-[3-(4-ethyl-2-methoxyphenoxy)phenyl]ethanone
CID 107665209
3,5-dichloro-6-(4-ethyl-2-methoxyphenoxy)-N-methylpyridin-2-amine
CID 107669668

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid?
The IUPAC name of 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid (CID 107664153) is 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid.
What is the SMILES notation for 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid?
The canonical SMILES for 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid is CCc1ccc(Oc2ncc(C(=O)O)cc2Cl)c(OC)c1.
What is the InChIKey of 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid?
The InChIKey is NMGSVFSLRCLOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO4/c1-3-9-4-5-12(13(6-9)20-2)21-14-11(16)7-10(8-17-14)15(18)19/h4-8H,3H2,1-2H3,(H,18,19).
What are the key properties of 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid?
5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid has a molecular weight of 307.73 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(4-ethyl-2-methoxyphenoxy)pyridine-3-carboxylic acid is sourced from PubChem (CID 107664153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).