4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one

C18H17NO3 — CID 59942448

IUPAC4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one
SMILESCC(C(=O)N1C(=O)OCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)17(20)19-16(12-22-18(19)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyKSSAAGMVSMKTSX-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.51
Rot. Bonds3

About 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one

4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one (PubChem CID 59942448) has the molecular formula C18H17NO3 and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one
PubChem CID59942448
Molecular FormulaC18H17NO3
Molecular Weight295.34 g/mol
Exact Mass295.12
IUPAC Name4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one
SMILESCC(C(=O)N1C(=O)OCC1c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)17(20)19-16(12-22-18(19)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyKSSAAGMVSMKTSX-UHFFFAOYSA-N
XLogP3.51
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3R)-1,4-bis[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-2,3-diphenylbutane-1,4-dione
CID 10482928
(4S)-3-[(2S,3R)-2-bromo-3-phenylbutanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 10023128
3-[(2R)-2-methyl-3-phenylpropanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 145030895
(4S)-4-phenyl-3-[(2R)-2-[(1S)-1-phenylethyl]pent-4-enoyl]-1,3-oxazolidin-2-one
CID 126708215
3-(3-methylbutanoyl)-4-phenyl-1,3-oxazolidin-2-one
CID 67991997
(3S)-4-oxo-4-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]-3-phenylbutanenitrile
CID 170640420
3-(2-methylhept-4-ynoyl)-4-phenyl-1,3-oxazolidin-2-one
CID 123161521
(4S)-3-[(2S)-2-[(1R)-1-hydroxyethyl]hexanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 134837890
(4S)-3-[(2S,3S)-2-bromo-3-hydroxy-3-(4-phenylphenyl)propanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 102063290
(4R)-3-[(2S,3R)-2-bromo-3-(4-bromophenyl)-3-hydroxypropanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 102063274
(4R)-3-[(2R,3R)-2-bromo-3-(2-bromophenyl)-3-hydroxypropanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 102063279
(4S)-3-[(2R,3S)-2-bromo-3-(4-tert-butylphenyl)-3-hydroxypropanoyl]-4-phenyl-1,3-oxazolidin-2-one
CID 15655656

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one?
The IUPAC name of 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one (CID 59942448) is 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one is CC(C(=O)N1C(=O)OCC1c1ccccc1)c1ccccc1.
What is the InChIKey of 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one?
The InChIKey is KSSAAGMVSMKTSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)17(20)19-16(12-22-18(19)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3.
What are the key properties of 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one?
4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one has a molecular weight of 295.34 g/mol, XLogP of 3.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-3-(2-phenylpropanoyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 59942448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).