4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid

C14H20N2O3 — CID 81053763

IUPAC4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid
SMILESCc1cc(N2CC(C)OCC2C)c(C(=O)O)c(C)n1
InChIInChI=1S/C14H20N2O3/c1-8-5-12(13(14(17)18)11(4)15-8)16-6-10(3)19-7-9(16)2/h5,9-10H,6-7H2,1-4H3,(H,17,18)
InChIKeyWNQGAMPYSHBHBO-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.01
Rot. Bonds2

About 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid

4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid (PubChem CID 81053763) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid
PubChem CID81053763
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid
SMILESCc1cc(N2CC(C)OCC2C)c(C(=O)O)c(C)n1
InChIInChI=1S/C14H20N2O3/c1-8-5-12(13(14(17)18)11(4)15-8)16-6-10(3)19-7-9(16)2/h5,9-10H,6-7H2,1-4H3,(H,17,18)
InChIKeyWNQGAMPYSHBHBO-UHFFFAOYSA-N
XLogP2.01
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,4-dimethylpiperazin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 114087919
2,6-dimethyl-4-(2-methylazepan-1-yl)pyridine-3-carboxylic acid
CID 81052989
2,6-dimethyl-4-(2,3,5-trimethylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 114597248
2-(2,5-dimethylmorpholin-4-yl)-5-methylbenzoic acid
CID 62514825
4-(3,4-dimethylpiperazin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 81052987
2-(5-ethyl-2-methylmorpholin-4-yl)-6-methylpyrimidine-4-carboxylic acid
CID 107553797
4-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 82752709
4-(3,4-dimethoxypyrrolidin-1-yl)-2,6-dimethylpyridine-3-carboxylic acid
CID 103540185
3-[4-(2,5-dimethylmorpholin-4-yl)-3-methylphenyl]prop-2-enoic acid
CID 76936160
[4-(2,5-dimethylmorpholin-4-yl)-6-methyl-3-pyridinyl]methanamine
CID 81246251
3-(2,5-dimethylmorpholin-4-yl)pyrazine-2-carboxylic acid
CID 55107513
[4-(5-ethyl-2-methylmorpholin-4-yl)-2,6-dimethyl-3-pyridinyl]methanamine
CID 81051008

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid?
The IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid (CID 81053763) is 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid.
What is the SMILES notation for 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid?
The canonical SMILES for 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid is Cc1cc(N2CC(C)OCC2C)c(C(=O)O)c(C)n1.
What is the InChIKey of 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid?
The InChIKey is WNQGAMPYSHBHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-8-5-12(13(14(17)18)11(4)15-8)16-6-10(3)19-7-9(16)2/h5,9-10H,6-7H2,1-4H3,(H,17,18).
What are the key properties of 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid?
4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid has a molecular weight of 264.32 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylmorpholin-4-yl)-2,6-dimethylpyridine-3-carboxylic acid is sourced from PubChem (CID 81053763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).