2-hexyl-3-methoxy-2,5-dihydrofuran

C11H20O2 — CID 11389794

IUPAC2-hexyl-3-methoxy-2,5-dihydrofuran
SMILESCCCCCCC1OCC=C1OC
InChIInChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3
InChIKeyXLQBWRHSEGSMFA-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.89
Rot. Bonds6

About 2-hexyl-3-methoxy-2,5-dihydrofuran

2-hexyl-3-methoxy-2,5-dihydrofuran (PubChem CID 11389794) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-hexyl-3-methoxy-2,5-dihydrofuran.

Molecular Properties

Compound Name2-hexyl-3-methoxy-2,5-dihydrofuran
PubChem CID11389794
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-hexyl-3-methoxy-2,5-dihydrofuran
SMILESCCCCCCC1OCC=C1OC
InChIInChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3
InChIKeyXLQBWRHSEGSMFA-UHFFFAOYSA-N
XLogP2.89
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 ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-hexyl-3-methoxy-2,5-dihydrofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hexyl-3-methoxy-2,5-dihydrofuran?
The IUPAC name of 2-hexyl-3-methoxy-2,5-dihydrofuran (CID 11389794) is 2-hexyl-3-methoxy-2,5-dihydrofuran.
What is the SMILES notation for 2-hexyl-3-methoxy-2,5-dihydrofuran?
The canonical SMILES for 2-hexyl-3-methoxy-2,5-dihydrofuran is CCCCCCC1OCC=C1OC.
What is the InChIKey of 2-hexyl-3-methoxy-2,5-dihydrofuran?
The InChIKey is XLQBWRHSEGSMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-6-7-11-10(12-2)8-9-13-11/h8,11H,3-7,9H2,1-2H3.
What are the key properties of 2-hexyl-3-methoxy-2,5-dihydrofuran?
2-hexyl-3-methoxy-2,5-dihydrofuran has a molecular weight of 184.28 g/mol, XLogP of 2.89, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hexyl-3-methoxy-2,5-dihydrofuran is sourced from PubChem (CID 11389794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).