(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane

C8H14F2O — CID 58995246

IUPAC(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
SMILESCC[C@H]1O[C@@H](C)C(F)(F)C1C
InChIInChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5?,6-,7+/m0/s1
InChIKeyGYHPTMCMNVNATA-BOJSHJERSA-N
MW164.19 g/mol
LogP2.46
Rot. Bonds1

About (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane

(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane (PubChem CID 58995246) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane.

Molecular Properties

Compound Name(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
PubChem CID58995246
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane
SMILESCC[C@H]1O[C@@H](C)C(F)(F)C1C
InChIInChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5?,6-,7+/m0/s1
InChIKeyGYHPTMCMNVNATA-BOJSHJERSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane 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 (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The IUPAC name of (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane (CID 58995246) is (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane.
What is the SMILES notation for (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The canonical SMILES for (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane is CC[C@H]1O[C@@H](C)C(F)(F)C1C.
What is the InChIKey of (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
The InChIKey is GYHPTMCMNVNATA-BOJSHJERSA-N. The full InChI is InChI=1S/C8H14F2O/c1-4-7-5(2)8(9,10)6(3)11-7/h5-7H,4H2,1-3H3/t5?,6-,7+/m0/s1.
What are the key properties of (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane?
(2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane has a molecular weight of 164.19 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5R)-5-ethyl-3,3-difluoro-2,4-dimethyloxolane is sourced from PubChem (CID 58995246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).