3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one

C15H19NO2 — CID 134964076

IUPAC3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one
SMILESCC/C(=C/N1CCOC1=O)CCc1ccccc1
InChIInChI=1S/C15H19NO2/c1-2-13(12-16-10-11-18-15(16)17)8-9-14-6-4-3-5-7-14/h3-7,12H,2,8-11H2,1H3/b13-12-
InChIKeyUVWCAWGFDCKZDH-SEYXRHQNSA-N
MW245.32 g/mol
LogP3.37
Rot. Bonds5

About 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one

3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one (PubChem CID 134964076) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one
PubChem CID134964076
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one
SMILESCC/C(=C/N1CCOC1=O)CCc1ccccc1
InChIInChI=1S/C15H19NO2/c1-2-13(12-16-10-11-18-15(16)17)8-9-14-6-4-3-5-7-14/h3-7,12H,2,8-11H2,1H3/b13-12-
InChIKeyUVWCAWGFDCKZDH-SEYXRHQNSA-N
XLogP3.37
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Fenpipalone
CID 30822
3-[2-(4-Fluorophenyl)ethynyl]-1,3-oxazolidin-2-one
CID 56946461
3-Cinnamoyloxazolidin-2-one
CID 677095
3-[(E)-1-fluoro-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 122391411
3-[(Z)-1-fluoro-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 132965775
3-[(Z)-2-fluoro-2-phenylethenyl]-1,3-oxazolidin-2-one
CID 132969632
3-[2-[3-(Trifluoromethyl)phenyl]ethynyl]-1,3-oxazolidin-2-one
CID 176422672
2-Oxazolidinone, 3-(1-oxo-3-phenyl-2-propenyl)-
CID 677094
(4S)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
CID 12078513
3-Styryl-oxazolidin-2-one
CID 13790906
(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
CID 14836208
3-(Phenylethynyl)oxazolidin-2-one
CID 23629254

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one (CID 134964076) is 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one is CC/C(=C/N1CCOC1=O)CCc1ccccc1.
What is the InChIKey of 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one?
The InChIKey is UVWCAWGFDCKZDH-SEYXRHQNSA-N. The full InChI is InChI=1S/C15H19NO2/c1-2-13(12-16-10-11-18-15(16)17)8-9-14-6-4-3-5-7-14/h3-7,12H,2,8-11H2,1H3/b13-12-.
What are the key properties of 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one?
3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one has a molecular weight of 245.32 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-2-ethyl-4-phenylbut-1-enyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 134964076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).