3-ethyl-3-(pent-1-enoxymethyl)oxetane

C11H20O2 — CID 154083040

IUPAC3-ethyl-3-(pent-1-enoxymethyl)oxetane
SMILESCCCC=COCC1(CC)COC1
InChIInChI=1S/C11H20O2/c1-3-5-6-7-12-8-11(4-2)9-13-10-11/h6-7H,3-5,8-10H2,1-2H3
InChIKeyUAVMMDVNBUSUBO-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.74
Rot. Bonds6

About 3-ethyl-3-(pent-1-enoxymethyl)oxetane

3-ethyl-3-(pent-1-enoxymethyl)oxetane (PubChem CID 154083040) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-ethyl-3-(pent-1-enoxymethyl)oxetane.

Molecular Properties

Compound Name3-ethyl-3-(pent-1-enoxymethyl)oxetane
PubChem CID154083040
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name3-ethyl-3-(pent-1-enoxymethyl)oxetane
SMILESCCCC=COCC1(CC)COC1
InChIInChI=1S/C11H20O2/c1-3-5-6-7-12-8-11(4-2)9-13-10-11/h6-7H,3-5,8-10H2,1-2H3
InChIKeyUAVMMDVNBUSUBO-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'}

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Related Compounds

5-Methoxy-4-(methoxymethyl)-4-methylpent-1-ene
CID 10855749
(1E)-1-methoxy-3,3-dimethylhexa-1,5-diene
CID 13967093
1-[(E)-prop-1-enoxy]-2,2-bis[[(E)-prop-1-enoxy]methyl]butane
CID 15357021
1-Prop-1-enoxy-2,2-bis(prop-1-enoxymethyl)butane
CID 57006238
3-(Ethenoxymethyl)-3-prop-2-enyloxetane
CID 67959482
3-Ethyl-3-[2-[2-(3-ethyloxetan-3-yl)ethenoxy]ethenyl]oxetane
CID 68625637
3-Prop-2-enyl-3-[(3-prop-2-enyloxetan-3-yl)methoxymethyl]oxetane
CID 70019190
1-Methoxy-3,3-dimethylhexa-1,5-diene
CID 85566466
3-Ethyl-3-(prop-1-enoxymethyl)oxetane
CID 85666303
1-Methoxy-4,4-dimethylpent-1-ene
CID 88653280
3-(But-3-enoxymethyl)-3-ethyloxetane
CID 89679007
1-(4,4-Dimethylpent-1-enoxy)-4,4-dimethylpent-1-ene
CID 91211835

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-(pent-1-enoxymethyl)oxetane?
The IUPAC name of 3-ethyl-3-(pent-1-enoxymethyl)oxetane (CID 154083040) is 3-ethyl-3-(pent-1-enoxymethyl)oxetane.
What is the SMILES notation for 3-ethyl-3-(pent-1-enoxymethyl)oxetane?
The canonical SMILES for 3-ethyl-3-(pent-1-enoxymethyl)oxetane is CCCC=COCC1(CC)COC1.
What is the InChIKey of 3-ethyl-3-(pent-1-enoxymethyl)oxetane?
The InChIKey is UAVMMDVNBUSUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-5-6-7-12-8-11(4-2)9-13-10-11/h6-7H,3-5,8-10H2,1-2H3.
What are the key properties of 3-ethyl-3-(pent-1-enoxymethyl)oxetane?
3-ethyl-3-(pent-1-enoxymethyl)oxetane 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 3-ethyl-3-(pent-1-enoxymethyl)oxetane is sourced from PubChem (CID 154083040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).