2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol

C8H15F2NO2 — CID 169181963

IUPAC2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol
SMILESOCC(NCC(F)F)C1CCOC1
InChIInChI=1S/C8H15F2NO2/c9-8(10)3-11-7(4-12)6-1-2-13-5-6/h6-8,11-12H,1-5H2
InChIKeyAIMIOSYILRCHRY-UHFFFAOYSA-N
MW195.21 g/mol
LogP0.24
Rot. Bonds5

About 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol

2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol (PubChem CID 169181963) has the molecular formula C8H15F2NO2 and a molecular weight of 195.21 g/mol. Its IUPAC name is 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol
PubChem CID169181963
Molecular FormulaC8H15F2NO2
Molecular Weight195.21 g/mol
Exact Mass195.11
IUPAC Name2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol
SMILESOCC(NCC(F)F)C1CCOC1
InChIInChI=1S/C8H15F2NO2/c9-8(10)3-11-7(4-12)6-1-2-13-5-6/h6-8,11-12H,1-5H2
InChIKeyAIMIOSYILRCHRY-UHFFFAOYSA-N
XLogP0.24
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.21
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol 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-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol?
The IUPAC name of 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol (CID 169181963) is 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol is OCC(NCC(F)F)C1CCOC1.
What is the InChIKey of 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol?
The InChIKey is AIMIOSYILRCHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO2/c9-8(10)3-11-7(4-12)6-1-2-13-5-6/h6-8,11-12H,1-5H2.
What are the key properties of 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol?
2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol has a molecular weight of 195.21 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluoroethylamino)-2-(oxolan-3-yl)ethanol is sourced from PubChem (CID 169181963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).