6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid

C14H11NO5 — CID 10923717

IUPAC6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid
SMILESCOc1ccccc1-c1ccc(C(=O)O)c(C(=O)O)n1
InChIInChI=1S/C14H11NO5/c1-20-11-5-3-2-4-8(11)10-7-6-9(13(16)17)12(15-10)14(18)19/h2-7H,1H3,(H,16,17)(H,18,19)
InChIKeyLDIFVOXQCHKTJE-UHFFFAOYSA-N
MW273.24 g/mol
LogP2.15
Rot. Bonds4

About 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid

6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid (PubChem CID 10923717) has the molecular formula C14H11NO5 and a molecular weight of 273.24 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid.

Molecular Properties

Compound Name6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid
PubChem CID10923717
Molecular FormulaC14H11NO5
Molecular Weight273.24 g/mol
Exact Mass273.06
IUPAC Name6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid
SMILESCOc1ccccc1-c1ccc(C(=O)O)c(C(=O)O)n1
InChIInChI=1S/C14H11NO5/c1-20-11-5-3-2-4-8(11)10-7-6-9(13(16)17)12(15-10)14(18)19/h2-7H,1H3,(H,16,17)(H,18,19)
InChIKeyLDIFVOXQCHKTJE-UHFFFAOYSA-N
XLogP2.15
TPSA96.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.24
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-6-(2-methoxyphenyl)pyridine-3-carboxylic acid
CID 116533920
6-(4-methoxyphenyl)pyridine-2,3-dicarboxylic acid
CID 16637669
2-[2-(2-methoxyphenyl)phenyl]benzoic acid
CID 67896375
3-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252544
2,9-bis(2-methoxyphenyl)-1,10-phenanthroline
CID 10691911
2-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxylic acid
CID 121001392
2-methoxy-3-(2-methoxyphenyl)benzoic acid
CID 53225402
4-chloro-2-(2-methoxyphenyl)benzoic acid
CID 53225407
2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]benzoic acid
CID 23008025
2-amino-6-(2-methoxyphenyl)pyrimidine-4-carboxylic acid
CID 28799604
2-methoxy-6-(2-methoxyphenyl)benzoic acid
CID 22380946
5-(2-methoxyphenyl)-1-propan-2-yltriazole-4-carboxylic acid
CID 82206744

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid?
The IUPAC name of 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid (CID 10923717) is 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid.
What is the SMILES notation for 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid?
The canonical SMILES for 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid is COc1ccccc1-c1ccc(C(=O)O)c(C(=O)O)n1.
What is the InChIKey of 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid?
The InChIKey is LDIFVOXQCHKTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO5/c1-20-11-5-3-2-4-8(11)10-7-6-9(13(16)17)12(15-10)14(18)19/h2-7H,1H3,(H,16,17)(H,18,19).
What are the key properties of 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid?
6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid has a molecular weight of 273.24 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid is sourced from PubChem (CID 10923717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).