4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid

C15H22N2O3 — CID 106589535

IUPAC4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid
SMILESCOCC1CCCN(c2cc(C)nc(C)c2C(=O)O)C1
InChIInChI=1S/C15H22N2O3/c1-10-7-13(14(15(18)19)11(2)16-10)17-6-4-5-12(8-17)9-20-3/h7,12H,4-6,8-9H2,1-3H3,(H,18,19)
InChIKeyXIRUFQAJDQZJCH-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.26
Rot. Bonds4

About 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid

4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid (PubChem CID 106589535) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid
PubChem CID106589535
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid
SMILESCOCC1CCCN(c2cc(C)nc(C)c2C(=O)O)C1
InChIInChI=1S/C15H22N2O3/c1-10-7-13(14(15(18)19)11(2)16-10)17-6-4-5-12(8-17)9-20-3/h7,12H,4-6,8-9H2,1-3H3,(H,18,19)
InChIKeyXIRUFQAJDQZJCH-UHFFFAOYSA-N
XLogP2.26
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-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

N'-hydroxy-4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboximidamide
CID 106587056
4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carbonitrile
CID 103823129
4-(3,4-dimethylpiperazin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 81052987
4-(3,4-dimethoxypyrrolidin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 103540185
4-[3-(diethylamino)pyrrolidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid
CID 81037184
2-chloro-6-[3-(methoxymethyl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 106587160
1-[2-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-4-pyridinyl]-N-methylmethanamine
CID 106589223
[1-[3-(aminomethyl)-2,6-dimethyl-4-pyridinyl]piperidin-3-yl]methanol
CID 81050851
4-(4,4-dimethylpiperidin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 81053376
4-(8-azaspiro[4.5]decan-8-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 81037183
6-anilino-5-(cyclobutanecarboximidoyl)-4-[3-(methoxymethyl)piperidin-1-yl]pyridine-2-carboxylic acid
CID 129023938
3-(chloromethyl)-2-[3-(methoxymethyl)piperidin-1-yl]-4,6-dimethylpyridine
CID 106588358

Frequently Asked Questions

What is the IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid?
The IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid (CID 106589535) is 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid.
What is the SMILES notation for 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid?
The canonical SMILES for 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid is COCC1CCCN(c2cc(C)nc(C)c2C(=O)O)C1.
What is the InChIKey of 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid?
The InChIKey is XIRUFQAJDQZJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10-7-13(14(15(18)19)11(2)16-10)17-6-4-5-12(8-17)9-20-3/h7,12H,4-6,8-9H2,1-3H3,(H,18,19).
What are the key properties of 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid?
4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid has a molecular weight of 278.35 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyridine-3-carboxylic acid is sourced from PubChem (CID 106589535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).