4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid

C11H21NO6 — CID 106991398

IUPAC4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid
SMILESCOCCOCC(O)CN1CCOC(C(=O)O)C1
InChIInChI=1S/C11H21NO6/c1-16-4-5-17-8-9(13)6-12-2-3-18-10(7-12)11(14)15/h9-10,13H,2-8H2,1H3,(H,14,15)
InChIKeyPSOMGFKSWFOYDL-UHFFFAOYSA-N
MW263.29 g/mol
LogP-1.20
Rot. Bonds8

About 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid

4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid (PubChem CID 106991398) has the molecular formula C11H21NO6 and a molecular weight of 263.29 g/mol. Its IUPAC name is 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid.

Molecular Properties

Compound Name4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid
PubChem CID106991398
Molecular FormulaC11H21NO6
Molecular Weight263.29 g/mol
Exact Mass263.14
IUPAC Name4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid
SMILESCOCCOCC(O)CN1CCOC(C(=O)O)C1
InChIInChI=1S/C11H21NO6/c1-16-4-5-17-8-9(13)6-12-2-3-18-10(7-12)11(14)15/h9-10,13H,2-8H2,1H3,(H,14,15)
InChIKeyPSOMGFKSWFOYDL-UHFFFAOYSA-N
XLogP-1.20
TPSA88.46 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 5-1.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-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 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid?
The IUPAC name of 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid (CID 106991398) is 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid.
What is the SMILES notation for 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid?
The canonical SMILES for 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid is COCCOCC(O)CN1CCOC(C(=O)O)C1.
What is the InChIKey of 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid?
The InChIKey is PSOMGFKSWFOYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO6/c1-16-4-5-17-8-9(13)6-12-2-3-18-10(7-12)11(14)15/h9-10,13H,2-8H2,1H3,(H,14,15).
What are the key properties of 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid?
4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid has a molecular weight of 263.29 g/mol, XLogP of -1.20, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydroxy-3-(2-methoxyethoxy)propyl]morpholine-2-carboxylic acid is sourced from PubChem (CID 106991398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).