1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone

C7H10FNO — CID 175874244

IUPAC1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone
SMILESCC(=O)N1CC(/C=C\F)C1
InChIInChI=1S/C7H10FNO/c1-6(10)9-4-7(5-9)2-3-8/h2-3,7H,4-5H2,1H3/b3-2-
InChIKeyDWVKKJAETIFQGG-IHWYPQMZSA-N
MW143.16 g/mol
LogP0.95
Rot. Bonds1

About 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone

1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone (PubChem CID 175874244) has the molecular formula C7H10FNO and a molecular weight of 143.16 g/mol. Its IUPAC name is 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone
PubChem CID175874244
Molecular FormulaC7H10FNO
Molecular Weight143.16 g/mol
Exact Mass143.07
IUPAC Name1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone
SMILESCC(=O)N1CC(/C=C\F)C1
InChIInChI=1S/C7H10FNO/c1-6(10)9-4-7(5-9)2-3-8/h2-3,7H,4-5H2,1H3/b3-2-
InChIKeyDWVKKJAETIFQGG-IHWYPQMZSA-N
XLogP0.95
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.16
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone?
The IUPAC name of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone (CID 175874244) is 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone.
What is the SMILES notation for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone?
The canonical SMILES for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone is CC(=O)N1CC(/C=C\F)C1.
What is the InChIKey of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone?
The InChIKey is DWVKKJAETIFQGG-IHWYPQMZSA-N. The full InChI is InChI=1S/C7H10FNO/c1-6(10)9-4-7(5-9)2-3-8/h2-3,7H,4-5H2,1H3/b3-2-.
What are the key properties of 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone?
1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone has a molecular weight of 143.16 g/mol, XLogP of 0.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(Z)-2-fluoroethenyl]azetidin-1-yl]ethanone is sourced from PubChem (CID 175874244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).