2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone

C11H12FNO — CID 84664669

IUPAC2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone
SMILESO=C(CC1CCN1)c1ccccc1F
InChIInChI=1S/C11H12FNO/c12-10-4-2-1-3-9(10)11(14)7-8-5-6-13-8/h1-4,8,13H,5-7H2
InChIKeyFNHHANAJHAAJHL-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.76
Rot. Bonds3

About 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone

2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone (PubChem CID 84664669) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone.

Molecular Properties

Compound Name2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone
PubChem CID84664669
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone
SMILESO=C(CC1CCN1)c1ccccc1F
InChIInChI=1S/C11H12FNO/c12-10-4-2-1-3-9(10)11(14)7-8-5-6-13-8/h1-4,8,13H,5-7H2
InChIKeyFNHHANAJHAAJHL-UHFFFAOYSA-N
XLogP1.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-2-yl)-1-(2-fluorophenyl)ethanone
CID 79538703
1-(2-hydroxyphenyl)-2-piperidin-2-ylethanone
CID 84684796
1-(5-chloro-2-fluorophenyl)-2-pyrrolidin-2-ylethanone
CID 116917007
2-(1,3-dithian-2-yl)-1-(2-fluorophenyl)ethanone
CID 122399001
3-[2-[2-(azetidin-2-yl)acetyl]phenyl]benzamide
CID 173118925
2-(4-methylpiperidin-2-yl)-1-naphthalen-1-ylethanone
CID 116685103
2-(azepan-2-yl)-1-[2-(trifluoromethyl)phenyl]ethanone
CID 79539404
1-(2-fluorophenyl)-3-methyl-3-piperazin-1-ylbutan-1-one
CID 116924095
1-(2-cyclobutylphenyl)-2-pyrrolidin-2-ylethanone
CID 114607499
1-benzyl-3-[2-(2-fluorophenyl)-2-oxoethyl]piperazin-2-one
CID 102002003
(2-fluorophenyl)-[(2R)-pyrrolidin-2-yl]methanone
CID 89281976
2-cyclopentylsulfinyl-1-(2-fluorophenyl)ethanone
CID 64639778

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone?
The IUPAC name of 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone (CID 84664669) is 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone.
What is the SMILES notation for 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone?
The canonical SMILES for 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone is O=C(CC1CCN1)c1ccccc1F.
What is the InChIKey of 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone?
The InChIKey is FNHHANAJHAAJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c12-10-4-2-1-3-9(10)11(14)7-8-5-6-13-8/h1-4,8,13H,5-7H2.
What are the key properties of 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone?
2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone has a molecular weight of 193.22 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-2-yl)-1-(2-fluorophenyl)ethanone is sourced from PubChem (CID 84664669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).