4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine

C12H23NO2 — CID 11047746

IUPAC4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine
SMILESCCC/C(=C/COCC)N1CCOCC1
InChIInChI=1S/C12H23NO2/c1-3-5-12(6-9-14-4-2)13-7-10-15-11-8-13/h6H,3-5,7-11H2,1-2H3/b12-6-
InChIKeyQZXVNWYAWPYKLL-SDQBBNPISA-N
MW213.32 g/mol
LogP2.04
Rot. Bonds6

About 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine

4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine (PubChem CID 11047746) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine.

Molecular Properties

Compound Name4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine
PubChem CID11047746
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine
SMILESCCC/C(=C/COCC)N1CCOCC1
InChIInChI=1S/C12H23NO2/c1-3-5-12(6-9-14-4-2)13-7-10-15-11-8-13/h6H,3-5,7-11H2,1-2H3/b12-6-
InChIKeyQZXVNWYAWPYKLL-SDQBBNPISA-N
XLogP2.04
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine?
The IUPAC name of 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine (CID 11047746) is 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine.
What is the SMILES notation for 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine?
The canonical SMILES for 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine is CCC/C(=C/COCC)N1CCOCC1.
What is the InChIKey of 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine?
The InChIKey is QZXVNWYAWPYKLL-SDQBBNPISA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-5-12(6-9-14-4-2)13-7-10-15-11-8-13/h6H,3-5,7-11H2,1-2H3/b12-6-.
What are the key properties of 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine?
4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine has a molecular weight of 213.32 g/mol, XLogP of 2.04, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-ethoxyhex-2-en-3-yl]morpholine is sourced from PubChem (CID 11047746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).