3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one

C11H11NO2 — CID 123895052

IUPAC3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one
SMILESC=C1OC(=O)N(C)C1c1ccccc1
InChIInChI=1S/C11H11NO2/c1-8-10(12(2)11(13)14-8)9-6-4-3-5-7-9/h3-7,10H,1H2,2H3
InChIKeyQCQMPLUDVVTAQW-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.32
Rot. Bonds1

About 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one

3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one (PubChem CID 123895052) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one
PubChem CID123895052
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one
SMILESC=C1OC(=O)N(C)C1c1ccccc1
InChIInChI=1S/C11H11NO2/c1-8-10(12(2)11(13)14-8)9-6-4-3-5-7-9/h3-7,10H,1H2,2H3
InChIKeyQCQMPLUDVVTAQW-UHFFFAOYSA-N
XLogP2.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one (CID 123895052) is 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one is C=C1OC(=O)N(C)C1c1ccccc1.
What is the InChIKey of 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one?
The InChIKey is QCQMPLUDVVTAQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-8-10(12(2)11(13)14-8)9-6-4-3-5-7-9/h3-7,10H,1H2,2H3.
What are the key properties of 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one?
3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one has a molecular weight of 189.21 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-methylidene-4-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 123895052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).