2-fluoro-N,N-dimethylacetamide

C4H8FNO — CID 5323646

IUPAC2-fluoro-N,N-dimethylacetamide
SMILESCN(C)C(=O)CF
InChIInChI=1S/C4H8FNO/c1-6(2)4(7)3-5/h3H2,1-2H3
InChIKeyATRYDVULSWIWKS-UHFFFAOYSA-N
MW105.11 g/mol
LogP0.04
Rot. Bonds1

About 2-fluoro-N,N-dimethylacetamide

2-fluoro-N,N-dimethylacetamide (PubChem CID 5323646) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is 2-fluoro-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-fluoro-N,N-dimethylacetamide
PubChem CID5323646
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC Name2-fluoro-N,N-dimethylacetamide
SMILESCN(C)C(=O)CF
InChIInChI=1S/C4H8FNO/c1-6(2)4(7)3-5/h3H2,1-2H3
InChIKeyATRYDVULSWIWKS-UHFFFAOYSA-N
XLogP0.04
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-N,N-dimethylacetamide 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-fluoro-N,N-dimethylacetamide?
The IUPAC name of 2-fluoro-N,N-dimethylacetamide (CID 5323646) is 2-fluoro-N,N-dimethylacetamide.
What is the SMILES notation for 2-fluoro-N,N-dimethylacetamide?
The canonical SMILES for 2-fluoro-N,N-dimethylacetamide is CN(C)C(=O)CF.
What is the InChIKey of 2-fluoro-N,N-dimethylacetamide?
The InChIKey is ATRYDVULSWIWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c1-6(2)4(7)3-5/h3H2,1-2H3.
What are the key properties of 2-fluoro-N,N-dimethylacetamide?
2-fluoro-N,N-dimethylacetamide has a molecular weight of 105.11 g/mol, XLogP of 0.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N-dimethylacetamide is sourced from PubChem (CID 5323646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).