4-ethyl-3-(phenoxymethyl)morpholine

C13H19NO2 — CID 140776542

IUPAC4-ethyl-3-(phenoxymethyl)morpholine
SMILESCCN1CCOCC1COc1ccccc1
InChIInChI=1S/C13H19NO2/c1-2-14-8-9-15-10-12(14)11-16-13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3
InChIKeyBZOVWUMWYPOIAI-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.79
Rot. Bonds4

About 4-ethyl-3-(phenoxymethyl)morpholine

4-ethyl-3-(phenoxymethyl)morpholine (PubChem CID 140776542) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-ethyl-3-(phenoxymethyl)morpholine.

Molecular Properties

Compound Name4-ethyl-3-(phenoxymethyl)morpholine
PubChem CID140776542
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name4-ethyl-3-(phenoxymethyl)morpholine
SMILESCCN1CCOCC1COc1ccccc1
InChIInChI=1S/C13H19NO2/c1-2-14-8-9-15-10-12(14)11-16-13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3
InChIKeyBZOVWUMWYPOIAI-UHFFFAOYSA-N
XLogP1.79
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-(phenoxymethyl)morpholine?
The IUPAC name of 4-ethyl-3-(phenoxymethyl)morpholine (CID 140776542) is 4-ethyl-3-(phenoxymethyl)morpholine.
What is the SMILES notation for 4-ethyl-3-(phenoxymethyl)morpholine?
The canonical SMILES for 4-ethyl-3-(phenoxymethyl)morpholine is CCN1CCOCC1COc1ccccc1.
What is the InChIKey of 4-ethyl-3-(phenoxymethyl)morpholine?
The InChIKey is BZOVWUMWYPOIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-2-14-8-9-15-10-12(14)11-16-13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3.
What are the key properties of 4-ethyl-3-(phenoxymethyl)morpholine?
4-ethyl-3-(phenoxymethyl)morpholine has a molecular weight of 221.30 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-(phenoxymethyl)morpholine is sourced from PubChem (CID 140776542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).