azetidin-2-yl(phenyl)methanone

C10H11NO — CID 84651225

IUPACazetidin-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)C1CCN1
InChIInChI=1S/C10H11NO/c12-10(9-6-7-11-9)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2
InChIKeyTZEJVXUJFAQIFH-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.23
Rot. Bonds2

About azetidin-2-yl(phenyl)methanone

azetidin-2-yl(phenyl)methanone (PubChem CID 84651225) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is azetidin-2-yl(phenyl)methanone.

Molecular Properties

Compound Nameazetidin-2-yl(phenyl)methanone
PubChem CID84651225
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Nameazetidin-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)C1CCN1
InChIInChI=1S/C10H11NO/c12-10(9-6-7-11-9)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2
InChIKeyTZEJVXUJFAQIFH-UHFFFAOYSA-N
XLogP1.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl(piperidin-2-yl)methanone
CID 19772085
phenyl-[(2S)-pyrrolidin-2-yl]methanone;2,2,2-trifluoroacetic acid
CID 21080202
(4-aminophenyl)-(azetidin-2-yl)methanone
CID 84655583
azetidin-2-yl-(3-bromophenyl)methanone
CID 84701782
(4-benzoylcyclohexyl)-phenylmethanone
CID 24722598
(4-bromophenyl)-[(2S)-pyrrolidin-2-yl]methanone
CID 42076627
(4-phenylmethoxyphenyl)-pyrrolidin-2-ylmethanone
CID 82550160
(2,6-diphenyl-4-pyridinyl)-[(2S)-pyrrolidin-2-yl]methanone
CID 174970018
7-benzoylazepan-2-one
CID 70255305
phenyl-[(3R)-pyrrolidin-3-yl]methanone
CID 86327261
[4-(hydroxymethyl)phenyl]-[(2R)-pyrrolidin-2-yl]methanone
CID 57323043
phenyl(1,3-thiazolidin-2-yl)methanone;hydrochloride
CID 138398651

Frequently Asked Questions

What is the IUPAC name of azetidin-2-yl(phenyl)methanone?
The IUPAC name of azetidin-2-yl(phenyl)methanone (CID 84651225) is azetidin-2-yl(phenyl)methanone.
What is the SMILES notation for azetidin-2-yl(phenyl)methanone?
The canonical SMILES for azetidin-2-yl(phenyl)methanone is O=C(c1ccccc1)C1CCN1.
What is the InChIKey of azetidin-2-yl(phenyl)methanone?
The InChIKey is TZEJVXUJFAQIFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c12-10(9-6-7-11-9)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2.
What are the key properties of azetidin-2-yl(phenyl)methanone?
azetidin-2-yl(phenyl)methanone has a molecular weight of 161.20 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-2-yl(phenyl)methanone is sourced from PubChem (CID 84651225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).