5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one

C15H15NO2 — CID 85177233

IUPAC5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one
SMILESCC1(C)OC(=O)NC1c1ccc2ccccc2c1
InChIInChI=1S/C15H15NO2/c1-15(2)13(16-14(17)18-15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,13H,1-2H3,(H,16,17)
InChIKeySDYMZUMYTPBGCK-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.40
Rot. Bonds1

About 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one

5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one (PubChem CID 85177233) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one
PubChem CID85177233
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one
SMILESCC1(C)OC(=O)NC1c1ccc2ccccc2c1
InChIInChI=1S/C15H15NO2/c1-15(2)13(16-14(17)18-15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,13H,1-2H3,(H,16,17)
InChIKeySDYMZUMYTPBGCK-UHFFFAOYSA-N
XLogP3.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one?
The IUPAC name of 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one (CID 85177233) is 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one is CC1(C)OC(=O)NC1c1ccc2ccccc2c1.
What is the InChIKey of 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one?
The InChIKey is SDYMZUMYTPBGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-15(2)13(16-14(17)18-15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,13H,1-2H3,(H,16,17).
What are the key properties of 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one?
5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one has a molecular weight of 241.29 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-4-naphthalen-2-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 85177233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).