6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid

C14H18N2O4 — CID 61424915

IUPAC6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
SMILESCCC1COC(C)CN1C(=O)c1cccc(C(=O)O)n1
InChIInChI=1S/C14H18N2O4/c1-3-10-8-20-9(2)7-16(10)13(17)11-5-4-6-12(15-11)14(18)19/h4-6,9-10H,3,7-8H2,1-2H3,(H,18,19)
InChIKeyUNBMZSXGYJSIJV-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.42
Rot. Bonds3

About 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid

6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid (PubChem CID 61424915) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
PubChem CID61424915
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid
SMILESCCC1COC(C)CN1C(=O)c1cccc(C(=O)O)n1
InChIInChI=1S/C14H18N2O4/c1-3-10-8-20-9(2)7-16(10)13(17)11-5-4-6-12(15-11)14(18)19/h4-6,9-10H,3,7-8H2,1-2H3,(H,18,19)
InChIKeyUNBMZSXGYJSIJV-UHFFFAOYSA-N
XLogP1.42
TPSA79.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid (CID 61424915) is 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid is CCC1COC(C)CN1C(=O)c1cccc(C(=O)O)n1.
What is the InChIKey of 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid?
The InChIKey is UNBMZSXGYJSIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-3-10-8-20-9(2)7-16(10)13(17)11-5-4-6-12(15-11)14(18)19/h4-6,9-10H,3,7-8H2,1-2H3,(H,18,19).
What are the key properties of 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid?
6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid has a molecular weight of 278.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-ethyl-2-methylmorpholine-4-carbonyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 61424915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).