2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid

C15H15NO4 — CID 60678753

IUPAC2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid
SMILESCOc1ccccc1Oc1nc(C)cc(C)c1C(=O)O
InChIInChI=1S/C15H15NO4/c1-9-8-10(2)16-14(13(9)15(17)18)20-12-7-5-4-6-11(12)19-3/h4-8H,1-3H3,(H,17,18)
InChIKeyCGMGHMHVAVSZEZ-UHFFFAOYSA-N
MW273.29 g/mol
LogP3.20
Rot. Bonds4

About 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid

2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid (PubChem CID 60678753) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid
PubChem CID60678753
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid
SMILESCOc1ccccc1Oc1nc(C)cc(C)c1C(=O)O
InChIInChI=1S/C15H15NO4/c1-9-8-10(2)16-14(13(9)15(17)18)20-12-7-5-4-6-11(12)19-3/h4-8H,1-3H3,(H,17,18)
InChIKeyCGMGHMHVAVSZEZ-UHFFFAOYSA-N
XLogP3.20
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-difluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 63268704
2-(4-fluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 60678648
2-(4-bromo-2-methylphenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 63217042
2-(2,4-dichlorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 60678494
4,6-dimethyl-2-(3-nitrophenoxy)pyridine-3-carboxylic acid
CID 60677891
2-(4-bromo-3-fluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 65203397
4-(2-methoxyphenoxy)-3-methylbenzoic acid
CID 62120451
2-but-3-enoxy-4,6-dimethylpyridine-3-carboxylic acid
CID 61003821
2-(3-bromo-5-fluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 81331677
2-(2,3-dimethylphenoxy)-4,6-dimethylpyridine-3-carbothioamide
CID 61176715
6-methoxy-4-methylpyridine-2,5-dicarboxylic acid
CID 91509956
4,6-dimethyl-2-(2-methylphenyl)sulfanylpyridine-3-carboxylic acid
CID 54896310

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid?
The IUPAC name of 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid (CID 60678753) is 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid.
What is the SMILES notation for 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid?
The canonical SMILES for 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid is COc1ccccc1Oc1nc(C)cc(C)c1C(=O)O.
What is the InChIKey of 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid?
The InChIKey is CGMGHMHVAVSZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-9-8-10(2)16-14(13(9)15(17)18)20-12-7-5-4-6-11(12)19-3/h4-8H,1-3H3,(H,17,18).
What are the key properties of 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid?
2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid has a molecular weight of 273.29 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-4,6-dimethylpyridine-3-carboxylic acid is sourced from PubChem (CID 60678753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).