1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane

C11H20O2 — CID 150416328

IUPAC1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane
SMILESCC=COCCC1CCC1OCC
InChIInChI=1S/C11H20O2/c1-3-8-12-9-7-10-5-6-11(10)13-4-2/h3,8,10-11H,4-7,9H2,1-2H3
InChIKeyHGWAAUKKJJGXDA-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.74
Rot. Bonds6

About 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane

1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane (PubChem CID 150416328) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane.

Molecular Properties

Compound Name1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane
PubChem CID150416328
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane
SMILESCC=COCCC1CCC1OCC
InChIInChI=1S/C11H20O2/c1-3-8-12-9-7-10-5-6-11(10)13-4-2/h3,8,10-11H,4-7,9H2,1-2H3
InChIKeyHGWAAUKKJJGXDA-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
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

1-(2-Prop-1-enoxyethyl)-2-(trifluoromethoxy)cyclobutane
CID 151522029
1-(1,1,2,2,2-Pentafluoroethoxy)-2-(2-prop-1-enoxyethyl)cyclobutane
CID 152459962
1-Ethoxy-1-(2-prop-1-enoxyethyl)cyclobutane
CID 150218499
2-Ethyl-3-(2-prop-1-enoxyethyl)oxetane
CID 150672672
2-Ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 151135874
1-Ethoxy-3-(methoxymethyl)cyclobutane;prop-1-ene
CID 161807878
4-[1-[(E)-prop-1-enoxy]ethyl]oxane
CID 176604227

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane?
The IUPAC name of 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane (CID 150416328) is 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane.
What is the SMILES notation for 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane?
The canonical SMILES for 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane is CC=COCCC1CCC1OCC.
What is the InChIKey of 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane?
The InChIKey is HGWAAUKKJJGXDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-8-12-9-7-10-5-6-11(10)13-4-2/h3,8,10-11H,4-7,9H2,1-2H3.
What are the key properties of 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane?
1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane has a molecular weight of 184.28 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-(2-prop-1-enoxyethyl)cyclobutane is sourced from PubChem (CID 150416328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).