2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid

C14H12N2O5 — CID 61395782

IUPAC2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid
SMILESCOc1cccc(C(=O)O)c1Oc1ncccc1C(N)=O
InChIInChI=1S/C14H12N2O5/c1-20-10-6-2-4-8(14(18)19)11(10)21-13-9(12(15)17)5-3-7-16-13/h2-7H,1H3,(H2,15,17)(H,18,19)
InChIKeyZGMZQIUYPGAWBQ-UHFFFAOYSA-N
MW288.26 g/mol
LogP1.68
Rot. Bonds5

About 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid

2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid (PubChem CID 61395782) has the molecular formula C14H12N2O5 and a molecular weight of 288.26 g/mol. Its IUPAC name is 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid.

Molecular Properties

Compound Name2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid
PubChem CID61395782
Molecular FormulaC14H12N2O5
Molecular Weight288.26 g/mol
Exact Mass288.07
IUPAC Name2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid
SMILESCOc1cccc(C(=O)O)c1Oc1ncccc1C(N)=O
InChIInChI=1S/C14H12N2O5/c1-20-10-6-2-4-8(14(18)19)11(10)21-13-9(12(15)17)5-3-7-16-13/h2-7H,1H3,(H2,15,17)(H,18,19)
InChIKeyZGMZQIUYPGAWBQ-UHFFFAOYSA-N
XLogP1.68
TPSA111.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic 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

2-(2,3-dimethoxyphenoxy)pyridine-3-carboxylic acid
CID 46779210
3-[(3-carbamoyl-2-pyridinyl)oxy]pyridine-4-carboxylic acid
CID 81443048
2-(4-amino-2-methoxyphenoxy)pyridine-3-carboxamide
CID 62111132
2-(2-carbamoyl-3-fluorophenoxy)pyridine-3-carboxylic acid
CID 43609549
2-(4-cyanopyridazin-3-yl)oxy-3-methoxybenzoic acid
CID 80516276
2-(2-methoxyphenoxy)pyridine-3-carbothioamide
CID 24702703
3-methoxy-2-pyrazin-2-yloxybenzoic acid
CID 61395817
2-[(5-bromo-6-oxo-1H-pyrimidin-4-yl)oxy]-3-methoxybenzoic acid
CID 114585664
N'-hydroxy-2-(2-methoxyphenoxy)pyridine-3-carboximidamide
CID 24711030
2,3-dimethoxybenzamide;hydrate
CID 141005510
2,3-dimethoxybenzoic acid;platinum;hydrate
CID 174478854
3-methoxy-2-thieno[2,3-d]pyrimidin-4-yloxybenzoic acid
CID 61395853

Frequently Asked Questions

What is the IUPAC name of 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid?
The IUPAC name of 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid (CID 61395782) is 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid.
What is the SMILES notation for 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid?
The canonical SMILES for 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid is COc1cccc(C(=O)O)c1Oc1ncccc1C(N)=O.
What is the InChIKey of 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid?
The InChIKey is ZGMZQIUYPGAWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O5/c1-20-10-6-2-4-8(14(18)19)11(10)21-13-9(12(15)17)5-3-7-16-13/h2-7H,1H3,(H2,15,17)(H,18,19).
What are the key properties of 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid?
2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid has a molecular weight of 288.26 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-carbamoyl-2-pyridinyl)oxy]-3-methoxybenzoic acid is sourced from PubChem (CID 61395782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).