N-fluoro-N-formylacetamide

C3H4FNO2 — CID 173232529

IUPACN-fluoro-N-formylacetamide
SMILESCC(=O)N(F)C=O
InChIInChI=1S/C3H4FNO2/c1-3(7)5(4)2-6/h2H,1H3
InChIKeyQWPCVKAKCDMWRK-UHFFFAOYSA-N
MW105.07 g/mol
LogP-0.12
Rot. Bonds1

About N-fluoro-N-formylacetamide

N-fluoro-N-formylacetamide (PubChem CID 173232529) has the molecular formula C3H4FNO2 and a molecular weight of 105.07 g/mol. Its IUPAC name is N-fluoro-N-formylacetamide.

Molecular Properties

Compound NameN-fluoro-N-formylacetamide
PubChem CID173232529
Molecular FormulaC3H4FNO2
Molecular Weight105.07 g/mol
Exact Mass105.02
IUPAC NameN-fluoro-N-formylacetamide
SMILESCC(=O)N(F)C=O
InChIInChI=1S/C3H4FNO2/c1-3(7)5(4)2-6/h2H,1H3
InChIKeyQWPCVKAKCDMWRK-UHFFFAOYSA-N
XLogP-0.12
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.07
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-fluoro-N-formylacetamide?
The IUPAC name of N-fluoro-N-formylacetamide (CID 173232529) is N-fluoro-N-formylacetamide.
What is the SMILES notation for N-fluoro-N-formylacetamide?
The canonical SMILES for N-fluoro-N-formylacetamide is CC(=O)N(F)C=O.
What is the InChIKey of N-fluoro-N-formylacetamide?
The InChIKey is QWPCVKAKCDMWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4FNO2/c1-3(7)5(4)2-6/h2H,1H3.
What are the key properties of N-fluoro-N-formylacetamide?
N-fluoro-N-formylacetamide has a molecular weight of 105.07 g/mol, XLogP of -0.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-N-formylacetamide is sourced from PubChem (CID 173232529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).