1-(2,2-difluoroethenyl)azetidin-2-one

C5H5F2NO — CID 143412253

IUPAC1-(2,2-difluoroethenyl)azetidin-2-one
SMILESO=C1CCN1C=C(F)F
InChIInChI=1S/C5H5F2NO/c6-4(7)3-8-2-1-5(8)9/h3H,1-2H2
InChIKeyRCUPKGHWEAPETF-UHFFFAOYSA-N
MW133.10 g/mol
LogP0.96
Rot. Bonds1

About 1-(2,2-difluoroethenyl)azetidin-2-one

1-(2,2-difluoroethenyl)azetidin-2-one (PubChem CID 143412253) has the molecular formula C5H5F2NO and a molecular weight of 133.10 g/mol. Its IUPAC name is 1-(2,2-difluoroethenyl)azetidin-2-one.

Molecular Properties

Compound Name1-(2,2-difluoroethenyl)azetidin-2-one
PubChem CID143412253
Molecular FormulaC5H5F2NO
Molecular Weight133.10 g/mol
Exact Mass133.03
IUPAC Name1-(2,2-difluoroethenyl)azetidin-2-one
SMILESO=C1CCN1C=C(F)F
InChIInChI=1S/C5H5F2NO/c6-4(7)3-8-2-1-5(8)9/h3H,1-2H2
InChIKeyRCUPKGHWEAPETF-UHFFFAOYSA-N
XLogP0.96
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.10
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-dihydroxyethenyl)pyrrolidin-2-one
CID 175238388
1-chloro-1-fluoroethene;1-(2-chloro-2-fluoroethenyl)pyrrolidin-2-one;methane
CID 162217428
2-[2,6-dioxo-5-(2-oxoethenyl)-1,5-diazocan-1-yl]acetic acid
CID 139993356
methyl (2E)-2-[(2-oxopyrrolidin-1-yl)methylidene]butanoate
CID 122230502
CID 86087838
CID 86087838
tetrakis(1-hydroxypyrrolidine-2,5-dione);λ2-stannane
CID 173205649
azane;1-hydroxypyrrolidine-2,5-dione
CID 11073454
1-silylazetidin-2-one
CID 71361238
1,1-dichloroethene;1-ethenylpyrrolidin-2-one
CID 19798230
bis(1-bromopyrrolidin-2-one);sulfane
CID 87187508
1-[(E)-3-oxobut-1-enyl]pyrrolidin-2-one
CID 131233341
1-ethenylpiperidin-2-one;1-ethenylpyrrolidin-2-one
CID 22992740

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethenyl)azetidin-2-one?
The IUPAC name of 1-(2,2-difluoroethenyl)azetidin-2-one (CID 143412253) is 1-(2,2-difluoroethenyl)azetidin-2-one.
What is the SMILES notation for 1-(2,2-difluoroethenyl)azetidin-2-one?
The canonical SMILES for 1-(2,2-difluoroethenyl)azetidin-2-one is O=C1CCN1C=C(F)F.
What is the InChIKey of 1-(2,2-difluoroethenyl)azetidin-2-one?
The InChIKey is RCUPKGHWEAPETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F2NO/c6-4(7)3-8-2-1-5(8)9/h3H,1-2H2.
What are the key properties of 1-(2,2-difluoroethenyl)azetidin-2-one?
1-(2,2-difluoroethenyl)azetidin-2-one has a molecular weight of 133.10 g/mol, XLogP of 0.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethenyl)azetidin-2-one is sourced from PubChem (CID 143412253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).