4-(2-penta-2,4-dien-2-yloxyethyl)morpholine

C11H19NO2 — CID 91541811

IUPAC4-(2-penta-2,4-dien-2-yloxyethyl)morpholine
SMILESC=CC=C(C)OCCN1CCOCC1
InChIInChI=1S/C11H19NO2/c1-3-4-11(2)14-10-7-12-5-8-13-9-6-12/h3-4H,1,5-10H2,2H3
InChIKeyIRACNVQOSKRJGK-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.42
Rot. Bonds5

About 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine

4-(2-penta-2,4-dien-2-yloxyethyl)morpholine (PubChem CID 91541811) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine.

Molecular Properties

Compound Name4-(2-penta-2,4-dien-2-yloxyethyl)morpholine
PubChem CID91541811
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name4-(2-penta-2,4-dien-2-yloxyethyl)morpholine
SMILESC=CC=C(C)OCCN1CCOCC1
InChIInChI=1S/C11H19NO2/c1-3-4-11(2)14-10-7-12-5-8-13-9-6-12/h3-4H,1,5-10H2,2H3
InChIKeyIRACNVQOSKRJGK-UHFFFAOYSA-N
XLogP1.42
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

4-[2-[(1E)-buta-1,3-dienoxy]ethyl]morpholine
CID 21937441
4-(2-Methoxyprop-2-enyl)-4-methylmorpholin-4-ium
CID 58053075
4,4-Bis(but-2-enyl)morpholin-4-ium
CID 68589115
4-[(1E,3Z)-3-ethoxypenta-1,3-dienyl]morpholine
CID 88860280
N,N-dimethyl-2-[(2E)-penta-2,4-dien-2-yl]oxyethanamine
CID 88918502
N-ethyl-N-methyl-2-[(2E)-penta-2,4-dien-2-yl]oxyethanamine
CID 88929526
Benzene;4-ethylmorpholine;oxocobalt
CID 89353225
4-(2-Prop-1-en-2-yloxyethyl)morpholine
CID 90245662
4-(2-Buta-1,3-dienoxyethyl)morpholine
CID 91136773
4-(3-Methoxyprop-2-enyl)morpholine
CID 91148955
4-(2-Buta-1,3-dien-2-yloxyethyl)morpholine
CID 91550852
4-[3-(4-Methoxyhexa-1,3,5-trien-3-yloxy)propyl]morpholine
CID 123223918

Frequently Asked Questions

What is the IUPAC name of 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine?
The IUPAC name of 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine (CID 91541811) is 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine.
What is the SMILES notation for 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine?
The canonical SMILES for 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine is C=CC=C(C)OCCN1CCOCC1.
What is the InChIKey of 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine?
The InChIKey is IRACNVQOSKRJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-4-11(2)14-10-7-12-5-8-13-9-6-12/h3-4H,1,5-10H2,2H3.
What are the key properties of 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine?
4-(2-penta-2,4-dien-2-yloxyethyl)morpholine has a molecular weight of 197.28 g/mol, XLogP of 1.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-penta-2,4-dien-2-yloxyethyl)morpholine is sourced from PubChem (CID 91541811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).