(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one

C18H17NO3 — CID 10902510

IUPAC(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one
SMILESC[C@H](c1ccccc1)N1C[C@@H](C(=O)c2ccccc2)OC1=O
InChIInChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)19-12-16(22-18(19)21)17(20)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3/t13-,16+/m1/s1
InChIKeyURSYRXMJMSCNQU-CJNGLKHVSA-N
MW295.34 g/mol
LogP3.45
Rot. Bonds4

About (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one

(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one (PubChem CID 10902510) has the molecular formula C18H17NO3 and a molecular weight of 295.34 g/mol. Its IUPAC name is (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one
PubChem CID10902510
Molecular FormulaC18H17NO3
Molecular Weight295.34 g/mol
Exact Mass295.12
IUPAC Name(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one
SMILESC[C@H](c1ccccc1)N1C[C@@H](C(=O)c2ccccc2)OC1=O
InChIInChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)19-12-16(22-18(19)21)17(20)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3/t13-,16+/m1/s1
InChIKeyURSYRXMJMSCNQU-CJNGLKHVSA-N
XLogP3.45
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one (CID 10902510) is (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one is C[C@H](c1ccccc1)N1C[C@@H](C(=O)c2ccccc2)OC1=O.
What is the InChIKey of (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one?
The InChIKey is URSYRXMJMSCNQU-CJNGLKHVSA-N. The full InChI is InChI=1S/C18H17NO3/c1-13(14-8-4-2-5-9-14)19-12-16(22-18(19)21)17(20)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3/t13-,16+/m1/s1.
What are the key properties of (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one?
(5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one has a molecular weight of 295.34 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-benzoyl-3-[(1R)-1-phenylethyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 10902510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).