2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane

C11H20O2 — CID 151135874

IUPAC2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
SMILESCCC1OCC1CCOC=C(C)C
InChIInChI=1S/C11H20O2/c1-4-11-10(8-13-11)5-6-12-7-9(2)3/h7,10-11H,4-6,8H2,1-3H3
InChIKeyMVEUUOLQPBWSIV-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.74
Rot. Bonds5

About 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane

2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane (PubChem CID 151135874) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane.

Molecular Properties

Compound Name2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
PubChem CID151135874
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
SMILESCCC1OCC1CCOC=C(C)C
InChIInChI=1S/C11H20O2/c1-4-11-10(8-13-11)5-6-12-7-9(2)3/h7,10-11H,4-6,8H2,1-3H3
InChIKeyMVEUUOLQPBWSIV-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(2-Methylprop-1-enoxy)ethyl]-2-(1,1,2,2,2-pentafluoroethyl)oxetane
CID 151698693
3-(2-Ethenoxyethyl)-2-ethyloxetane
CID 141483489
1-Ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane
CID 150416328
2-Ethyl-3-(2-prop-1-enoxyethyl)oxetane
CID 150672672
2-Methyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151531127
3-Ethyl-2-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151866383
3-[2-(2-Methylprop-1-enoxy)ethyl]oxane
CID 176604943

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The IUPAC name of 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane (CID 151135874) is 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane.
What is the SMILES notation for 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The canonical SMILES for 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane is CCC1OCC1CCOC=C(C)C.
What is the InChIKey of 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
The InChIKey is MVEUUOLQPBWSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-4-11-10(8-13-11)5-6-12-7-9(2)3/h7,10-11H,4-6,8H2,1-3H3.
What are the key properties of 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane?
2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane has a molecular weight of 184.28 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane is sourced from PubChem (CID 151135874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).