6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid

C10H13NO5 — CID 67398889

IUPAC6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid
SMILESCOc1nc(C(OC)OC)ccc1C(=O)O
InChIInChI=1S/C10H13NO5/c1-14-8-6(9(12)13)4-5-7(11-8)10(15-2)16-3/h4-5,10H,1-3H3,(H,12,13)
InChIKeyVYLZFAHCUZDZFZ-UHFFFAOYSA-N
MW227.22 g/mol
LogP1.08
Rot. Bonds5

About 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid

6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid (PubChem CID 67398889) has the molecular formula C10H13NO5 and a molecular weight of 227.22 g/mol. Its IUPAC name is 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid
PubChem CID67398889
Molecular FormulaC10H13NO5
Molecular Weight227.22 g/mol
Exact Mass227.08
IUPAC Name6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid
SMILESCOc1nc(C(OC)OC)ccc1C(=O)O
InChIInChI=1S/C10H13NO5/c1-14-8-6(9(12)13)4-5-7(11-8)10(15-2)16-3/h4-5,10H,1-3H3,(H,12,13)
InChIKeyVYLZFAHCUZDZFZ-UHFFFAOYSA-N
XLogP1.08
TPSA77.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic 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-methoxy-6-methylpyridine-3-carboxylic acid
CID 22494228
6-bromo-2-methoxypyridine-3-carboxylic acid
CID 71303922
6-(difluoromethyl)-2,3-dimethoxypyridine-4-carboxylic acid
CID 130100962
6-chloro-2-(4-methoxyphenoxy)pyridine-3-carboxylic acid
CID 63376924
4-methoxy-2-methylsulfanylpyrimidine-5-carboxylic acid
CID 12829003
5-methoxypyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 84664492
2-bromo-6-propan-2-ylpyridine-3-carboxylic acid
CID 84704265
6-(4-methoxyphenyl)pyridine-2,3-dicarboxylic acid
CID 16637669
6-chloro-5-ethyl-2-methoxypyridine-3-carboxylic acid
CID 89421780
6-chloro-2-methoxypyridine-3-carbonyl chloride;hydrochloride
CID 156880920
3-methoxy-1,2-oxazole-4-carboxylic acid
CID 24860323
7-acetyl-2-methoxy-5,6,8,9-tetrahydropyrido[2,3-d]azepine-3-carboxylic acid
CID 82624622

Frequently Asked Questions

What is the IUPAC name of 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid?
The IUPAC name of 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid (CID 67398889) is 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid.
What is the SMILES notation for 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid?
The canonical SMILES for 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid is COc1nc(C(OC)OC)ccc1C(=O)O.
What is the InChIKey of 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid?
The InChIKey is VYLZFAHCUZDZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO5/c1-14-8-6(9(12)13)4-5-7(11-8)10(15-2)16-3/h4-5,10H,1-3H3,(H,12,13).
What are the key properties of 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid?
6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid has a molecular weight of 227.22 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethoxymethyl)-2-methoxypyridine-3-carboxylic acid is sourced from PubChem (CID 67398889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).