3-ethyl-4-(2-phenylethenyl)azetidin-2-one

C13H15NO — CID 54427704

IUPAC3-ethyl-4-(2-phenylethenyl)azetidin-2-one
SMILESCCC1C(=O)NC1C=Cc1ccccc1
InChIInChI=1S/C13H15NO/c1-2-11-12(14-13(11)15)9-8-10-6-4-3-5-7-10/h3-9,11-12H,2H2,1H3,(H,14,15)
InChIKeyWFHDMOCYIZPLGJ-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.22
Rot. Bonds3

About 3-ethyl-4-(2-phenylethenyl)azetidin-2-one

3-ethyl-4-(2-phenylethenyl)azetidin-2-one (PubChem CID 54427704) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-ethyl-4-(2-phenylethenyl)azetidin-2-one.

Molecular Properties

Compound Name3-ethyl-4-(2-phenylethenyl)azetidin-2-one
PubChem CID54427704
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name3-ethyl-4-(2-phenylethenyl)azetidin-2-one
SMILESCCC1C(=O)NC1C=Cc1ccccc1
InChIInChI=1S/C13H15NO/c1-2-11-12(14-13(11)15)9-8-10-6-4-3-5-7-10/h3-9,11-12H,2H2,1H3,(H,14,15)
InChIKeyWFHDMOCYIZPLGJ-UHFFFAOYSA-N
XLogP2.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S,4R)-3-methoxy-4-(2-phenylethenyl)azetidin-2-one
CID 67831878
4-[(E)-2-phenylethenyl]-3-propan-2-ylazetidin-2-one
CID 70066029
ethyl N-[2-oxo-4-(2-phenylethenyl)azetidin-3-yl]carbamate
CID 70500389
(3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-[(E)-2-phenylethenyl]azetidin-2-one
CID 53254254
(3R,4S)-3-[(1S)-1-[dimethyl(phenyl)silyl]ethyl]-4-[(E)-2-phenylethenyl]azetidin-2-one
CID 10806744
[(1S)-1-[(3S,4S)-2-oxo-4-[(E)-2-phenylethenyl]azetidin-3-yl]ethyl] dodecanoate
CID 10597081
3-(2-phenylethenyl)-4-propylideneoxolane-2,5-dione
CID 57149375
4-benzyl-3-ethylazetidin-2-one
CID 85185683
N-[(3R,4S)-2-oxo-4-[(E)-2-phenylethenyl]azetidin-3-yl]-2-phenoxyacetamide
CID 70574394
5-acetyl-4-ethoxy-6-[(E)-2-phenylethenyl]-1,3-diazinan-2-one
CID 102399861
3-ethyl-4-prop-1-enylazetidin-2-one;1-methylazetidine
CID 91245189
3-methyl-2-[(E)-2-phenylethenyl]-2,3,6,7-tetrahydro-1H-quinolin-4-one
CID 135128680

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-(2-phenylethenyl)azetidin-2-one?
The IUPAC name of 3-ethyl-4-(2-phenylethenyl)azetidin-2-one (CID 54427704) is 3-ethyl-4-(2-phenylethenyl)azetidin-2-one.
What is the SMILES notation for 3-ethyl-4-(2-phenylethenyl)azetidin-2-one?
The canonical SMILES for 3-ethyl-4-(2-phenylethenyl)azetidin-2-one is CCC1C(=O)NC1C=Cc1ccccc1.
What is the InChIKey of 3-ethyl-4-(2-phenylethenyl)azetidin-2-one?
The InChIKey is WFHDMOCYIZPLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-11-12(14-13(11)15)9-8-10-6-4-3-5-7-10/h3-9,11-12H,2H2,1H3,(H,14,15).
What are the key properties of 3-ethyl-4-(2-phenylethenyl)azetidin-2-one?
3-ethyl-4-(2-phenylethenyl)azetidin-2-one has a molecular weight of 201.27 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-(2-phenylethenyl)azetidin-2-one is sourced from PubChem (CID 54427704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).