3-amino-1-(2-fluoroethenyl)azetidin-2-one

C5H7FN2O — CID 131849042

IUPAC3-amino-1-(2-fluoroethenyl)azetidin-2-one
SMILESNC1CN(C=CF)C1=O
InChIInChI=1S/C5H7FN2O/c6-1-2-8-3-4(7)5(8)9/h1-2,4H,3,7H2
InChIKeyGPEREYZTFDTTKB-UHFFFAOYSA-N
MW130.12 g/mol
LogP-0.40
Rot. Bonds1

About 3-amino-1-(2-fluoroethenyl)azetidin-2-one

3-amino-1-(2-fluoroethenyl)azetidin-2-one (PubChem CID 131849042) has the molecular formula C5H7FN2O and a molecular weight of 130.12 g/mol. Its IUPAC name is 3-amino-1-(2-fluoroethenyl)azetidin-2-one.

Molecular Properties

Compound Name3-amino-1-(2-fluoroethenyl)azetidin-2-one
PubChem CID131849042
Molecular FormulaC5H7FN2O
Molecular Weight130.12 g/mol
Exact Mass130.05
IUPAC Name3-amino-1-(2-fluoroethenyl)azetidin-2-one
SMILESNC1CN(C=CF)C1=O
InChIInChI=1S/C5H7FN2O/c6-1-2-8-3-4(7)5(8)9/h1-2,4H,3,7H2
InChIKeyGPEREYZTFDTTKB-UHFFFAOYSA-N
XLogP-0.40
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.12
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-fluoroethenyl)azetidin-2-one?
The IUPAC name of 3-amino-1-(2-fluoroethenyl)azetidin-2-one (CID 131849042) is 3-amino-1-(2-fluoroethenyl)azetidin-2-one.
What is the SMILES notation for 3-amino-1-(2-fluoroethenyl)azetidin-2-one?
The canonical SMILES for 3-amino-1-(2-fluoroethenyl)azetidin-2-one is NC1CN(C=CF)C1=O.
What is the InChIKey of 3-amino-1-(2-fluoroethenyl)azetidin-2-one?
The InChIKey is GPEREYZTFDTTKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2O/c6-1-2-8-3-4(7)5(8)9/h1-2,4H,3,7H2.
What are the key properties of 3-amino-1-(2-fluoroethenyl)azetidin-2-one?
3-amino-1-(2-fluoroethenyl)azetidin-2-one has a molecular weight of 130.12 g/mol, XLogP of -0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-fluoroethenyl)azetidin-2-one is sourced from PubChem (CID 131849042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).