4,4-dimethyl-2-phenyl-1,3-oxazolidine

C11H15NO — CID 589827

IUPAC4,4-dimethyl-2-phenyl-1,3-oxazolidine
SMILESCC1(C)COC(c2ccccc2)N1
InChIInChI=1S/C11H15NO/c1-11(2)8-13-10(12-11)9-6-4-3-5-7-9/h3-7,10,12H,8H2,1-2H3
InChIKeyZYUWGAVXDLKUKT-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.08
Rot. Bonds1

About 4,4-dimethyl-2-phenyl-1,3-oxazolidine

4,4-dimethyl-2-phenyl-1,3-oxazolidine (PubChem CID 589827) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 4,4-dimethyl-2-phenyl-1,3-oxazolidine.

Molecular Properties

Compound Name4,4-dimethyl-2-phenyl-1,3-oxazolidine
PubChem CID589827
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name4,4-dimethyl-2-phenyl-1,3-oxazolidine
SMILESCC1(C)COC(c2ccccc2)N1
InChIInChI=1S/C11H15NO/c1-11(2)8-13-10(12-11)9-6-4-3-5-7-9/h3-7,10,12H,8H2,1-2H3
InChIKeyZYUWGAVXDLKUKT-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4,4-dimethyl-2-phenyl-1,3-oxazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-2-phenyl-1,3-oxazolidine?
The IUPAC name of 4,4-dimethyl-2-phenyl-1,3-oxazolidine (CID 589827) is 4,4-dimethyl-2-phenyl-1,3-oxazolidine.
What is the SMILES notation for 4,4-dimethyl-2-phenyl-1,3-oxazolidine?
The canonical SMILES for 4,4-dimethyl-2-phenyl-1,3-oxazolidine is CC1(C)COC(c2ccccc2)N1.
What is the InChIKey of 4,4-dimethyl-2-phenyl-1,3-oxazolidine?
The InChIKey is ZYUWGAVXDLKUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-11(2)8-13-10(12-11)9-6-4-3-5-7-9/h3-7,10,12H,8H2,1-2H3.
What are the key properties of 4,4-dimethyl-2-phenyl-1,3-oxazolidine?
4,4-dimethyl-2-phenyl-1,3-oxazolidine has a molecular weight of 177.25 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-2-phenyl-1,3-oxazolidine is sourced from PubChem (CID 589827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).