2,2-diethyl-4-propylmorpholine

C11H23NO — CID 90928577

IUPAC2,2-diethyl-4-propylmorpholine
SMILESCCCN1CCOC(CC)(CC)C1
InChIInChI=1S/C11H23NO/c1-4-7-12-8-9-13-11(5-2,6-3)10-12/h4-10H2,1-3H3
InChIKeyJVTSDDGCZAJKGH-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.29
Rot. Bonds4

About 2,2-diethyl-4-propylmorpholine

2,2-diethyl-4-propylmorpholine (PubChem CID 90928577) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,2-diethyl-4-propylmorpholine.

Molecular Properties

Compound Name2,2-diethyl-4-propylmorpholine
PubChem CID90928577
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,2-diethyl-4-propylmorpholine
SMILESCCCN1CCOC(CC)(CC)C1
InChIInChI=1S/C11H23NO/c1-4-7-12-8-9-13-11(5-2,6-3)10-12/h4-10H2,1-3H3
InChIKeyJVTSDDGCZAJKGH-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-4-propylmorpholine?
The IUPAC name of 2,2-diethyl-4-propylmorpholine (CID 90928577) is 2,2-diethyl-4-propylmorpholine.
What is the SMILES notation for 2,2-diethyl-4-propylmorpholine?
The canonical SMILES for 2,2-diethyl-4-propylmorpholine is CCCN1CCOC(CC)(CC)C1.
What is the InChIKey of 2,2-diethyl-4-propylmorpholine?
The InChIKey is JVTSDDGCZAJKGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-7-12-8-9-13-11(5-2,6-3)10-12/h4-10H2,1-3H3.
What are the key properties of 2,2-diethyl-4-propylmorpholine?
2,2-diethyl-4-propylmorpholine has a molecular weight of 185.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-4-propylmorpholine is sourced from PubChem (CID 90928577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).