ethane;2-ethyl-3,4-dimethylfuran

C10H18O — CID 154656296

IUPACethane;2-ethyl-3,4-dimethylfuran
SMILESCC.CCc1occ(C)c1C
InChIInChI=1S/C8H12O.C2H6/c1-4-8-7(3)6(2)5-9-8;1-2/h5H,4H2,1-3H3;1-2H3
InChIKeyJHDBMJCUMNYAOR-UHFFFAOYSA-N
MW154.25 g/mol
LogP3.49
Rot. Bonds1

About ethane;2-ethyl-3,4-dimethylfuran

ethane;2-ethyl-3,4-dimethylfuran (PubChem CID 154656296) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is ethane;2-ethyl-3,4-dimethylfuran.

Molecular Properties

Compound Nameethane;2-ethyl-3,4-dimethylfuran
PubChem CID154656296
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Nameethane;2-ethyl-3,4-dimethylfuran
SMILESCC.CCc1occ(C)c1C
InChIInChI=1S/C8H12O.C2H6/c1-4-8-7(3)6(2)5-9-8;1-2/h5H,4H2,1-3H3;1-2H3
InChIKeyJHDBMJCUMNYAOR-UHFFFAOYSA-N
XLogP3.49
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethane;2-ethyl-3,4-dimethylfuran 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 ethane;2-ethyl-3,4-dimethylfuran?
The IUPAC name of ethane;2-ethyl-3,4-dimethylfuran (CID 154656296) is ethane;2-ethyl-3,4-dimethylfuran.
What is the SMILES notation for ethane;2-ethyl-3,4-dimethylfuran?
The canonical SMILES for ethane;2-ethyl-3,4-dimethylfuran is CC.CCc1occ(C)c1C.
What is the InChIKey of ethane;2-ethyl-3,4-dimethylfuran?
The InChIKey is JHDBMJCUMNYAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O.C2H6/c1-4-8-7(3)6(2)5-9-8;1-2/h5H,4H2,1-3H3;1-2H3.
What are the key properties of ethane;2-ethyl-3,4-dimethylfuran?
ethane;2-ethyl-3,4-dimethylfuran has a molecular weight of 154.25 g/mol, XLogP of 3.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethyl-3,4-dimethylfuran is sourced from PubChem (CID 154656296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).