3,3-diethylmorpholine

C8H17NO — CID 22689127

IUPAC3,3-diethylmorpholine
SMILESCCC1(CC)COCCN1
InChIInChI=1S/C8H17NO/c1-3-8(4-2)7-10-6-5-9-8/h9H,3-7H2,1-2H3
InChIKeyIBUHLOOKFGLSOI-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.16
Rot. Bonds2

About 3,3-diethylmorpholine

3,3-diethylmorpholine (PubChem CID 22689127) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3,3-diethylmorpholine.

Molecular Properties

Compound Name3,3-diethylmorpholine
PubChem CID22689127
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3,3-diethylmorpholine
SMILESCCC1(CC)COCCN1
InChIInChI=1S/C8H17NO/c1-3-8(4-2)7-10-6-5-9-8/h9H,3-7H2,1-2H3
InChIKeyIBUHLOOKFGLSOI-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,3-diethylmorpholine 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 3,3-diethylmorpholine?
The IUPAC name of 3,3-diethylmorpholine (CID 22689127) is 3,3-diethylmorpholine.
What is the SMILES notation for 3,3-diethylmorpholine?
The canonical SMILES for 3,3-diethylmorpholine is CCC1(CC)COCCN1.
What is the InChIKey of 3,3-diethylmorpholine?
The InChIKey is IBUHLOOKFGLSOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-8(4-2)7-10-6-5-9-8/h9H,3-7H2,1-2H3.
What are the key properties of 3,3-diethylmorpholine?
3,3-diethylmorpholine has a molecular weight of 143.23 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethylmorpholine is sourced from PubChem (CID 22689127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).