2-(prop-2-enoxymethyl)-4-propylmorpholine

C11H21NO2 — CID 21430412

IUPAC2-(prop-2-enoxymethyl)-4-propylmorpholine
SMILESC=CCOCC1CN(CCC)CCO1
InChIInChI=1S/C11H21NO2/c1-3-5-12-6-8-14-11(9-12)10-13-7-4-2/h4,11H,2-3,5-10H2,1H3
InChIKeyFOAGHUHVJSYCDO-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.30
Rot. Bonds6

About 2-(prop-2-enoxymethyl)-4-propylmorpholine

2-(prop-2-enoxymethyl)-4-propylmorpholine (PubChem CID 21430412) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-(prop-2-enoxymethyl)-4-propylmorpholine.

Molecular Properties

Compound Name2-(prop-2-enoxymethyl)-4-propylmorpholine
PubChem CID21430412
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-(prop-2-enoxymethyl)-4-propylmorpholine
SMILESC=CCOCC1CN(CCC)CCO1
InChIInChI=1S/C11H21NO2/c1-3-5-12-6-8-14-11(9-12)10-13-7-4-2/h4,11H,2-3,5-10H2,1H3
InChIKeyFOAGHUHVJSYCDO-UHFFFAOYSA-N
XLogP1.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(prop-2-enoxymethyl)-4-propylmorpholine?
The IUPAC name of 2-(prop-2-enoxymethyl)-4-propylmorpholine (CID 21430412) is 2-(prop-2-enoxymethyl)-4-propylmorpholine.
What is the SMILES notation for 2-(prop-2-enoxymethyl)-4-propylmorpholine?
The canonical SMILES for 2-(prop-2-enoxymethyl)-4-propylmorpholine is C=CCOCC1CN(CCC)CCO1.
What is the InChIKey of 2-(prop-2-enoxymethyl)-4-propylmorpholine?
The InChIKey is FOAGHUHVJSYCDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-5-12-6-8-14-11(9-12)10-13-7-4-2/h4,11H,2-3,5-10H2,1H3.
What are the key properties of 2-(prop-2-enoxymethyl)-4-propylmorpholine?
2-(prop-2-enoxymethyl)-4-propylmorpholine has a molecular weight of 199.29 g/mol, XLogP of 1.30, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(prop-2-enoxymethyl)-4-propylmorpholine is sourced from PubChem (CID 21430412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).