2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine

C6H8F2N2O — CID 103829349

IUPAC2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine
SMILESFC(F)CNCc1ccno1
InChIInChI=1S/C6H8F2N2O/c7-6(8)4-9-3-5-1-2-10-11-5/h1-2,6,9H,3-4H2
InChIKeyHDXAVORSIXBNKT-UHFFFAOYSA-N
MW162.14 g/mol
LogP1.03
Rot. Bonds4

About 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine

2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine (PubChem CID 103829349) has the molecular formula C6H8F2N2O and a molecular weight of 162.14 g/mol. Its IUPAC name is 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine.

Molecular Properties

Compound Name2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine
PubChem CID103829349
Molecular FormulaC6H8F2N2O
Molecular Weight162.14 g/mol
Exact Mass162.06
IUPAC Name2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine
SMILESFC(F)CNCc1ccno1
InChIInChI=1S/C6H8F2N2O/c7-6(8)4-9-3-5-1-2-10-11-5/h1-2,6,9H,3-4H2
InChIKeyHDXAVORSIXBNKT-UHFFFAOYSA-N
XLogP1.03
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine 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-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The IUPAC name of 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine (CID 103829349) is 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine.
What is the SMILES notation for 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The canonical SMILES for 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine is FC(F)CNCc1ccno1.
What is the InChIKey of 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine?
The InChIKey is HDXAVORSIXBNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2N2O/c7-6(8)4-9-3-5-1-2-10-11-5/h1-2,6,9H,3-4H2.
What are the key properties of 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine?
2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine has a molecular weight of 162.14 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-(1,2-oxazol-5-ylmethyl)ethanamine is sourced from PubChem (CID 103829349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).