2-ethyl-1,1-difluorocyclopropane

C5H8F2 — CID 23368033

IUPAC2-ethyl-1,1-difluorocyclopropane
SMILESCCC1CC1(F)F
InChIInChI=1S/C5H8F2/c1-2-4-3-5(4,6)7/h4H,2-3H2,1H3
InChIKeyNNHJAGVJGIPACA-UHFFFAOYSA-N
MW106.12 g/mol
LogP2.05
Rot. Bonds1

About 2-ethyl-1,1-difluorocyclopropane

2-ethyl-1,1-difluorocyclopropane (PubChem CID 23368033) has the molecular formula C5H8F2 and a molecular weight of 106.12 g/mol. Its IUPAC name is 2-ethyl-1,1-difluorocyclopropane.

Molecular Properties

Compound Name2-ethyl-1,1-difluorocyclopropane
PubChem CID23368033
Molecular FormulaC5H8F2
Molecular Weight106.12 g/mol
Exact Mass106.06
IUPAC Name2-ethyl-1,1-difluorocyclopropane
SMILESCCC1CC1(F)F
InChIInChI=1S/C5H8F2/c1-2-4-3-5(4,6)7/h4H,2-3H2,1H3
InChIKeyNNHJAGVJGIPACA-UHFFFAOYSA-N
XLogP2.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.12
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-ethyl-1,1-difluorocyclopropane 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-ethyl-1,1-difluorocyclopropane?
The IUPAC name of 2-ethyl-1,1-difluorocyclopropane (CID 23368033) is 2-ethyl-1,1-difluorocyclopropane.
What is the SMILES notation for 2-ethyl-1,1-difluorocyclopropane?
The canonical SMILES for 2-ethyl-1,1-difluorocyclopropane is CCC1CC1(F)F.
What is the InChIKey of 2-ethyl-1,1-difluorocyclopropane?
The InChIKey is NNHJAGVJGIPACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F2/c1-2-4-3-5(4,6)7/h4H,2-3H2,1H3.
What are the key properties of 2-ethyl-1,1-difluorocyclopropane?
2-ethyl-1,1-difluorocyclopropane has a molecular weight of 106.12 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,1-difluorocyclopropane is sourced from PubChem (CID 23368033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).