3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid

C14H20N2O3 — CID 63074878

IUPAC3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid
SMILESCC1CN(Cc2cccnc2C(=O)O)CC(C)(C)O1
InChIInChI=1S/C14H20N2O3/c1-10-7-16(9-14(2,3)19-10)8-11-5-4-6-15-12(11)13(17)18/h4-6,10H,7-9H2,1-3H3,(H,17,18)
InChIKeyKWPJMKXDRKJESL-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.78
Rot. Bonds3

About 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid

3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid (PubChem CID 63074878) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid
PubChem CID63074878
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid
SMILESCC1CN(Cc2cccnc2C(=O)O)CC(C)(C)O1
InChIInChI=1S/C14H20N2O3/c1-10-7-16(9-14(2,3)19-10)8-11-5-4-6-15-12(11)13(17)18/h4-6,10H,7-9H2,1-3H3,(H,17,18)
InChIKeyKWPJMKXDRKJESL-UHFFFAOYSA-N
XLogP1.78
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-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 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid?
The IUPAC name of 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid (CID 63074878) is 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid?
The canonical SMILES for 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid is CC1CN(Cc2cccnc2C(=O)O)CC(C)(C)O1.
What is the InChIKey of 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid?
The InChIKey is KWPJMKXDRKJESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-7-16(9-14(2,3)19-10)8-11-5-4-6-15-12(11)13(17)18/h4-6,10H,7-9H2,1-3H3,(H,17,18).
What are the key properties of 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid?
3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid has a molecular weight of 264.32 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 63074878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).