(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one

C18H17NO2 — CID 11185073

IUPAC(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
SMILESC/C(=C/N1C(=O)OC[C@@H]1c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NO2/c1-14(15-8-4-2-5-9-15)12-19-17(13-21-18(19)20)16-10-6-3-7-11-16/h2-12,17H,13H2,1H3/b14-12-/t17-/m1/s1
InChIKeyYYBYEZJSFRBESU-BHEFUSTPSA-N
MW279.34 g/mol
LogP4.24
Rot. Bonds3

About (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one

(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one (PubChem CID 11185073) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
PubChem CID11185073
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one
SMILESC/C(=C/N1C(=O)OC[C@@H]1c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17NO2/c1-14(15-8-4-2-5-9-15)12-19-17(13-21-18(19)20)16-10-6-3-7-11-16/h2-12,17H,13H2,1H3/b14-12-/t17-/m1/s1
InChIKeyYYBYEZJSFRBESU-BHEFUSTPSA-N
XLogP4.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The IUPAC name of (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one (CID 11185073) is (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one is C/C(=C/N1C(=O)OC[C@@H]1c1ccccc1)c1ccccc1.
What is the InChIKey of (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
The InChIKey is YYBYEZJSFRBESU-BHEFUSTPSA-N. The full InChI is InChI=1S/C18H17NO2/c1-14(15-8-4-2-5-9-15)12-19-17(13-21-18(19)20)16-10-6-3-7-11-16/h2-12,17H,13H2,1H3/b14-12-/t17-/m1/s1.
What are the key properties of (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one?
(4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one has a molecular weight of 279.34 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-phenyl-3-[(Z)-2-phenylprop-1-enyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 11185073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).