ethanamine;dihydrofluoride

C2H9F2N — CID 173025850

IUPACethanamine;dihydrofluoride
SMILESCCN.F.F
InChIInChI=1S/C2H7N.2FH/c1-2-3;;/h2-3H2,1H3;2*1H
InChIKeyFHEMEXLVNHAAGN-UHFFFAOYSA-N
MW85.10 g/mol
LogP0.27
Rot. Bonds

About ethanamine;dihydrofluoride

ethanamine;dihydrofluoride (PubChem CID 173025850) has the molecular formula C2H9F2N and a molecular weight of 85.10 g/mol. Its IUPAC name is ethanamine;dihydrofluoride.

Molecular Properties

Compound Nameethanamine;dihydrofluoride
PubChem CID173025850
Molecular FormulaC2H9F2N
Molecular Weight85.10 g/mol
Exact Mass85.07
IUPAC Nameethanamine;dihydrofluoride
SMILESCCN.F.F
InChIInChI=1S/C2H7N.2FH/c1-2-3;;/h2-3H2,1H3;2*1H
InChIKeyFHEMEXLVNHAAGN-UHFFFAOYSA-N
XLogP0.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.10
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze ethanamine;dihydrofluoride 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 ethanamine;dihydrofluoride?
The IUPAC name of ethanamine;dihydrofluoride (CID 173025850) is ethanamine;dihydrofluoride.
What is the SMILES notation for ethanamine;dihydrofluoride?
The canonical SMILES for ethanamine;dihydrofluoride is CCN.F.F.
What is the InChIKey of ethanamine;dihydrofluoride?
The InChIKey is FHEMEXLVNHAAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N.2FH/c1-2-3;;/h2-3H2,1H3;2*1H.
What are the key properties of ethanamine;dihydrofluoride?
ethanamine;dihydrofluoride has a molecular weight of 85.10 g/mol, XLogP of 0.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;dihydrofluoride is sourced from PubChem (CID 173025850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).