3-ethylmorpholine

C6H13NO — CID 14267782

IUPAC3-ethylmorpholine
SMILESCCC1COCCN1
InChIInChI=1S/C6H13NO/c1-2-6-5-8-4-3-7-6/h6-7H,2-5H2,1H3
InChIKeyJBQWQBSRIAGTJT-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.38
Rot. Bonds1

About 3-ethylmorpholine

3-ethylmorpholine (PubChem CID 14267782) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 3-ethylmorpholine.

Molecular Properties

Compound Name3-ethylmorpholine
PubChem CID14267782
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name3-ethylmorpholine
SMILESCCC1COCCN1
InChIInChI=1S/C6H13NO/c1-2-6-5-8-4-3-7-6/h6-7H,2-5H2,1H3
InChIKeyJBQWQBSRIAGTJT-UHFFFAOYSA-N
XLogP0.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethylmorpholine?
The IUPAC name of 3-ethylmorpholine (CID 14267782) is 3-ethylmorpholine.
What is the SMILES notation for 3-ethylmorpholine?
The canonical SMILES for 3-ethylmorpholine is CCC1COCCN1.
What is the InChIKey of 3-ethylmorpholine?
The InChIKey is JBQWQBSRIAGTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-2-6-5-8-4-3-7-6/h6-7H,2-5H2,1H3.
What are the key properties of 3-ethylmorpholine?
3-ethylmorpholine has a molecular weight of 115.18 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylmorpholine is sourced from PubChem (CID 14267782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).