5-benzyl-3-methyl-1,3-oxazolidin-2-one

C11H13NO2 — CID 3046888

IUPAC5-benzyl-3-methyl-1,3-oxazolidin-2-one
SMILESCN1CC(Cc2ccccc2)OC1=O
InChIInChI=1S/C11H13NO2/c1-12-8-10(14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKeyUZJQTLVIRDTJTM-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.68
Rot. Bonds2

About 5-benzyl-3-methyl-1,3-oxazolidin-2-one

5-benzyl-3-methyl-1,3-oxazolidin-2-one (PubChem CID 3046888) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-benzyl-3-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-benzyl-3-methyl-1,3-oxazolidin-2-one
PubChem CID3046888
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name5-benzyl-3-methyl-1,3-oxazolidin-2-one
SMILESCN1CC(Cc2ccccc2)OC1=O
InChIInChI=1S/C11H13NO2/c1-12-8-10(14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKeyUZJQTLVIRDTJTM-UHFFFAOYSA-N
XLogP1.68
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-3-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-benzyl-3-methyl-1,3-oxazolidin-2-one (CID 3046888) is 5-benzyl-3-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-benzyl-3-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-benzyl-3-methyl-1,3-oxazolidin-2-one is CN1CC(Cc2ccccc2)OC1=O.
What is the InChIKey of 5-benzyl-3-methyl-1,3-oxazolidin-2-one?
The InChIKey is UZJQTLVIRDTJTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-12-8-10(14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3.
What are the key properties of 5-benzyl-3-methyl-1,3-oxazolidin-2-one?
5-benzyl-3-methyl-1,3-oxazolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-3-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 3046888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).