3-ethyl-2,5-dihydrofuran

C6H10O — CID 15825450

IUPAC3-ethyl-2,5-dihydrofuran
SMILESCCC1=CCOC1
InChIInChI=1S/C6H10O/c1-2-6-3-4-7-5-6/h3H,2,4-5H2,1H3
InChIKeyKGLGCLRHKKNANH-UHFFFAOYSA-N
MW98.14 g/mol
LogP1.35
Rot. Bonds1

About 3-ethyl-2,5-dihydrofuran

3-ethyl-2,5-dihydrofuran (PubChem CID 15825450) has the molecular formula C6H10O and a molecular weight of 98.14 g/mol. Its IUPAC name is 3-ethyl-2,5-dihydrofuran.

Molecular Properties

Compound Name3-ethyl-2,5-dihydrofuran
PubChem CID15825450
Molecular FormulaC6H10O
Molecular Weight98.14 g/mol
Exact Mass98.07
IUPAC Name3-ethyl-2,5-dihydrofuran
SMILESCCC1=CCOC1
InChIInChI=1S/C6H10O/c1-2-6-3-4-7-5-6/h3H,2,4-5H2,1H3
InChIKeyKGLGCLRHKKNANH-UHFFFAOYSA-N
XLogP1.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.14
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,5-dihydrofuran?
The IUPAC name of 3-ethyl-2,5-dihydrofuran (CID 15825450) is 3-ethyl-2,5-dihydrofuran.
What is the SMILES notation for 3-ethyl-2,5-dihydrofuran?
The canonical SMILES for 3-ethyl-2,5-dihydrofuran is CCC1=CCOC1.
What is the InChIKey of 3-ethyl-2,5-dihydrofuran?
The InChIKey is KGLGCLRHKKNANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O/c1-2-6-3-4-7-5-6/h3H,2,4-5H2,1H3.
What are the key properties of 3-ethyl-2,5-dihydrofuran?
3-ethyl-2,5-dihydrofuran has a molecular weight of 98.14 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,5-dihydrofuran is sourced from PubChem (CID 15825450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).