3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one

C12H13NO2 — CID 101211960

IUPAC3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
SMILESC/C(=C\N1CCOC1=O)c1ccccc1
InChIInChI=1S/C12H13NO2/c1-10(11-5-3-2-4-6-11)9-13-7-8-15-12(13)14/h2-6,9H,7-8H2,1H3/b10-9+
InChIKeyOIGRYPMUJPBEJU-MDZDMXLPSA-N
MW203.24 g/mol
LogP2.50
Rot. Bonds2

About 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one

3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one (PubChem CID 101211960) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
PubChem CID101211960
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
SMILESC/C(=C\N1CCOC1=O)c1ccccc1
InChIInChI=1S/C12H13NO2/c1-10(11-5-3-2-4-6-11)9-13-7-8-15-12(13)14/h2-6,9H,7-8H2,1H3/b10-9+
InChIKeyOIGRYPMUJPBEJU-MDZDMXLPSA-N
XLogP2.50
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(E)-2-[dimethyl(phenyl)silyl]-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 132504006
1-[(Z)-2-phenylprop-1-enyl]aziridine
CID 87132052
4-(2-phenylprop-1-enyl)morpholine
CID 85373526
N-[(Z)-3-(2-oxo-1,3-oxazolidin-3-yl)prop-2-enoyl]benzamide
CID 177479355
3-[(E)-2-(2-methylphenyl)ethenyl]-1,3-oxazolidin-2-one
CID 122402062
(Z)-2-(2-oxo-1,3-oxazolidin-3-yl)-3-phenylbut-2-enoic acid
CID 177477909
3-[(1E,8Z)-9-hydroxy-7-oxo-9-phenylnona-1,8-dienyl]-1,3-oxazolidin-2-one
CID 134942241
(E)-N-benzyl-3-(2-oxo-1,3-oxazolidin-3-yl)prop-2-enamide
CID 101460563
N-(2-oxo-1,3-oxazolidin-3-yl)-N-phenylacetamide
CID 21293121
3-[(E)-1-iodo-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 78210230
3-[(Z)-2-(4-methylphenyl)ethenyl]-1,3-oxazolidin-2-one
CID 73056739
3-[(Z)-1-fluoro-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 132965775

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one (CID 101211960) is 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one is C/C(=C\N1CCOC1=O)c1ccccc1.
What is the InChIKey of 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The InChIKey is OIGRYPMUJPBEJU-MDZDMXLPSA-N. The full InChI is InChI=1S/C12H13NO2/c1-10(11-5-3-2-4-6-11)9-13-7-8-15-12(13)14/h2-6,9H,7-8H2,1H3/b10-9+.
What are the key properties of 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one has a molecular weight of 203.24 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 101211960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).