6-(4-methoxyanilino)pyridine-2-carboxylic acid

C13H12N2O3 — CID 55053217

IUPAC6-(4-methoxyanilino)pyridine-2-carboxylic acid
SMILESCOc1ccc(Nc2cccc(C(=O)O)n2)cc1
InChIInChI=1S/C13H12N2O3/c1-18-10-7-5-9(6-8-10)14-12-4-2-3-11(15-12)13(16)17/h2-8H,1H3,(H,14,15)(H,16,17)
InChIKeyAKMMGBMSIKIDSO-UHFFFAOYSA-N
MW244.25 g/mol
LogP2.53
Rot. Bonds4

About 6-(4-methoxyanilino)pyridine-2-carboxylic acid

6-(4-methoxyanilino)pyridine-2-carboxylic acid (PubChem CID 55053217) has the molecular formula C13H12N2O3 and a molecular weight of 244.25 g/mol. Its IUPAC name is 6-(4-methoxyanilino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(4-methoxyanilino)pyridine-2-carboxylic acid
PubChem CID55053217
Molecular FormulaC13H12N2O3
Molecular Weight244.25 g/mol
Exact Mass244.08
IUPAC Name6-(4-methoxyanilino)pyridine-2-carboxylic acid
SMILESCOc1ccc(Nc2cccc(C(=O)O)n2)cc1
InChIInChI=1S/C13H12N2O3/c1-18-10-7-5-9(6-8-10)14-12-4-2-3-11(15-12)13(16)17/h2-8H,1H3,(H,14,15)(H,16,17)
InChIKeyAKMMGBMSIKIDSO-UHFFFAOYSA-N
XLogP2.53
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2,5-dimethoxyanilino)pyridine-2-carboxylic acid
CID 62254625
6-[(3-methoxyphenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 63642574
6-[2-(4-methoxyphenoxy)propylamino]pyridine-2-carboxylic acid
CID 122048336
6-(4-bromo-3,5-dimethylanilino)pyridine-2-carboxylic acid
CID 107575447
6-[4-[4-(2-propan-2-ylphenyl)anilino]anilino]pyridine-2-carboxylic acid
CID 155133729
6-(4-chloro-3-fluoroanilino)pyridine-2-carboxylic acid
CID 62240911
2,6-dimethoxy-N-[6-(4-methoxyanilino)pyridazin-3-yl]benzamide
CID 113048302
6-(2,6-dichloroanilino)pyridine-2-carboxylic acid
CID 65499397
6-[3-(3-methoxyphenyl)propylamino]pyridine-2-carboxylic acid
CID 122053549
N-(6-anilinopyridazin-3-yl)-4-methoxybenzamide
CID 113045480
6-chloro-N-(4-methoxyphenyl)pyridin-2-amine;2,6-dichloropyridine;4-methoxyaniline
CID 161024546
2-(4-methoxyanilino)-3-methylbenzoic acid
CID 174942223

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyanilino)pyridine-2-carboxylic acid?
The IUPAC name of 6-(4-methoxyanilino)pyridine-2-carboxylic acid (CID 55053217) is 6-(4-methoxyanilino)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(4-methoxyanilino)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(4-methoxyanilino)pyridine-2-carboxylic acid is COc1ccc(Nc2cccc(C(=O)O)n2)cc1.
What is the InChIKey of 6-(4-methoxyanilino)pyridine-2-carboxylic acid?
The InChIKey is AKMMGBMSIKIDSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O3/c1-18-10-7-5-9(6-8-10)14-12-4-2-3-11(15-12)13(16)17/h2-8H,1H3,(H,14,15)(H,16,17).
What are the key properties of 6-(4-methoxyanilino)pyridine-2-carboxylic acid?
6-(4-methoxyanilino)pyridine-2-carboxylic acid has a molecular weight of 244.25 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyanilino)pyridine-2-carboxylic acid is sourced from PubChem (CID 55053217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).