2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol

C9H19NO4 — CID 135137976

IUPAC2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol
SMILESCOCC(O)OCCN1CCOCC1
InChIInChI=1S/C9H19NO4/c1-12-8-9(11)14-7-4-10-2-5-13-6-3-10/h9,11H,2-8H2,1H3
InChIKeyJWQULOSJOVZJPO-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.70
Rot. Bonds6

About 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol

2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol (PubChem CID 135137976) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol.

Molecular Properties

Compound Name2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol
PubChem CID135137976
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC Name2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol
SMILESCOCC(O)OCCN1CCOCC1
InChIInChI=1S/C9H19NO4/c1-12-8-9(11)14-7-4-10-2-5-13-6-3-10/h9,11H,2-8H2,1H3
InChIKeyJWQULOSJOVZJPO-UHFFFAOYSA-N
XLogP-0.70
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol?
The IUPAC name of 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol (CID 135137976) is 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol.
What is the SMILES notation for 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol?
The canonical SMILES for 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol is COCC(O)OCCN1CCOCC1.
What is the InChIKey of 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol?
The InChIKey is JWQULOSJOVZJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-12-8-9(11)14-7-4-10-2-5-13-6-3-10/h9,11H,2-8H2,1H3.
What are the key properties of 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol?
2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol has a molecular weight of 205.25 g/mol, XLogP of -0.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-morpholin-4-ylethoxy)ethanol is sourced from PubChem (CID 135137976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).