2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid

C14H20N2O2 — CID 113378624

IUPAC2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(N2CCC(C)CC2C)n1
InChIInChI=1S/C14H20N2O2/c1-9-4-5-16(11(3)6-9)13-8-12(14(17)18)7-10(2)15-13/h7-9,11H,4-6H2,1-3H3,(H,17,18)
InChIKeyCVNZZPSWJPUNGM-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.71
Rot. Bonds2

About 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid

2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid (PubChem CID 113378624) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid
PubChem CID113378624
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid
SMILESCc1cc(C(=O)O)cc(N2CCC(C)CC2C)n1
InChIInChI=1S/C14H20N2O2/c1-9-4-5-16(11(3)6-9)13-8-12(14(17)18)7-10(2)15-13/h7-9,11H,4-6H2,1-3H3,(H,17,18)
InChIKeyCVNZZPSWJPUNGM-UHFFFAOYSA-N
XLogP2.71
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid (CID 113378624) is 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid is Cc1cc(C(=O)O)cc(N2CCC(C)CC2C)n1.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid?
The InChIKey is CVNZZPSWJPUNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-9-4-5-16(11(3)6-9)13-8-12(14(17)18)7-10(2)15-13/h7-9,11H,4-6H2,1-3H3,(H,17,18).
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid?
2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid has a molecular weight of 248.33 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperidin-1-yl)-6-methylpyridine-4-carboxylic acid is sourced from PubChem (CID 113378624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).