(3S)-3-phenylmethoxyazetidin-2-one

C10H11NO2 — CID 10773649

IUPAC(3S)-3-phenylmethoxyazetidin-2-one
SMILESO=C1NC[C@@H]1OCc1ccccc1
InChIInChI=1S/C10H11NO2/c12-10-9(6-11-10)13-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m0/s1
InChIKeyOJBPEOQRPHSVHO-VIFPVBQESA-N
MW177.20 g/mol
LogP0.70
Rot. Bonds3

About (3S)-3-phenylmethoxyazetidin-2-one

(3S)-3-phenylmethoxyazetidin-2-one (PubChem CID 10773649) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is (3S)-3-phenylmethoxyazetidin-2-one.

Molecular Properties

Compound Name(3S)-3-phenylmethoxyazetidin-2-one
PubChem CID10773649
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name(3S)-3-phenylmethoxyazetidin-2-one
SMILESO=C1NC[C@@H]1OCc1ccccc1
InChIInChI=1S/C10H11NO2/c12-10-9(6-11-10)13-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m0/s1
InChIKeyOJBPEOQRPHSVHO-VIFPVBQESA-N
XLogP0.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2,3,4,5,6-pentakis(phenylmethoxy)cyclohexyl]oxymethylbenzene
CID 10747453
ethane;2-phenylmethoxycyclobutan-1-one
CID 143382516
4,4-dideuterio-2-phenylmethoxycyclopentan-1-one
CID 171581931
3-hydroxy-2-(hydroxymethyl)-5-phenylmethoxycyclopentan-1-one
CID 123567944
(3R)-3-phenylmethoxyoxan-4-one
CID 59445816
(2R,3S,5R,6S)-2,3,4,5,6-pentakis(phenylmethoxy)cyclohexan-1-one
CID 45157418
3,4,5-tris(phenylmethoxy)piperidine
CID 14642637
benzyl N-methyl-N-(2-oxoazetidin-3-yl)carbamate
CID 90426419
benzyl 2,6-dimethyl-3-oxopiperazine-1-carboxylate
CID 54133253
benzyl (2S)-2,6-dimethyl-3-oxopiperazine-1-carboxylate
CID 57066025
(2S,3R)-2-methyl-3-phenylmethoxyazetidine
CID 163409920
(3R)-2-methyl-3,5-bis(phenylmethoxy)oxan-4-one
CID 146795417

Frequently Asked Questions

What is the IUPAC name of (3S)-3-phenylmethoxyazetidin-2-one?
The IUPAC name of (3S)-3-phenylmethoxyazetidin-2-one (CID 10773649) is (3S)-3-phenylmethoxyazetidin-2-one.
What is the SMILES notation for (3S)-3-phenylmethoxyazetidin-2-one?
The canonical SMILES for (3S)-3-phenylmethoxyazetidin-2-one is O=C1NC[C@@H]1OCc1ccccc1.
What is the InChIKey of (3S)-3-phenylmethoxyazetidin-2-one?
The InChIKey is OJBPEOQRPHSVHO-VIFPVBQESA-N. The full InChI is InChI=1S/C10H11NO2/c12-10-9(6-11-10)13-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m0/s1.
What are the key properties of (3S)-3-phenylmethoxyazetidin-2-one?
(3S)-3-phenylmethoxyazetidin-2-one has a molecular weight of 177.20 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-phenylmethoxyazetidin-2-one is sourced from PubChem (CID 10773649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).