3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one

C18H19NO2 — CID 118225756

IUPAC3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one
SMILESO=C1C(CCc2ccccc2)CN1OCc1ccccc1
InChIInChI=1S/C18H19NO2/c20-18-17(12-11-15-7-3-1-4-8-15)13-19(18)21-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2
InChIKeyZYDXGRQDEUBQCX-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.21
Rot. Bonds6

About 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one

3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one (PubChem CID 118225756) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one.

Molecular Properties

Compound Name3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one
PubChem CID118225756
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one
SMILESO=C1C(CCc2ccccc2)CN1OCc1ccccc1
InChIInChI=1S/C18H19NO2/c20-18-17(12-11-15-7-3-1-4-8-15)13-19(18)21-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2
InChIKeyZYDXGRQDEUBQCX-UHFFFAOYSA-N
XLogP3.21
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4R)-3-amino-4-ethyl-1-phenylmethoxypyrrolidin-2-one
CID 131201426
3-hydrazinyl-4-methyl-1-phenylmethoxypyrrolidin-2-one
CID 23052513
(5S)-5-(2-phenylethyl)-1-phenylmethoxyimidazolidin-2-one
CID 132578257
1-methyl-3-(2-phenylethyl)pyrrolidin-2-one
CID 24974613
3-(methylamino)-1-phenylmethoxypyrrolidin-2-one
CID 69151134
5-bromo-1-phenylmethoxypyrrolidin-2-one
CID 22495511
1-phenylmethoxyazetidin-3-amine
CID 162036959
(3S,4R)-3,4-dimethyl-1-phenylmethoxyazetidin-2-one
CID 10104396
2-[(3R)-2-oxo-1-phenylmethoxypiperidin-3-yl]isoindole-1,3-dione
CID 102437877
3-cyclopropyl-2-(2-oxo-3-phenylmethoxyimidazolidin-1-yl)propanoic acid
CID 155352899
3-(2-methylpropanethioyl)-1-phenylmethoxypyrrolidin-2-one
CID 156716509
(4R)-4-methyl-1-phenylmethoxyazetidin-2-one
CID 16752815

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one?
The IUPAC name of 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one (CID 118225756) is 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one.
What is the SMILES notation for 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one?
The canonical SMILES for 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one is O=C1C(CCc2ccccc2)CN1OCc1ccccc1.
What is the InChIKey of 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one?
The InChIKey is ZYDXGRQDEUBQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c20-18-17(12-11-15-7-3-1-4-8-15)13-19(18)21-14-16-9-5-2-6-10-16/h1-10,17H,11-14H2.
What are the key properties of 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one?
3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one has a molecular weight of 281.36 g/mol, XLogP of 3.21, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenylethyl)-1-phenylmethoxyazetidin-2-one is sourced from PubChem (CID 118225756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).