2,4-ditert-butyl-1,3-oxazolidine

C11H23NO — CID 18720035

IUPAC2,4-ditert-butyl-1,3-oxazolidine
SMILESCC(C)(C)C1COC(C(C)(C)C)N1
InChIInChI=1S/C11H23NO/c1-10(2,3)8-7-13-9(12-8)11(4,5)6/h8-9,12H,7H2,1-6H3
InChIKeyIMJOPSACTORHOD-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.39
Rot. Bonds

About 2,4-ditert-butyl-1,3-oxazolidine

2,4-ditert-butyl-1,3-oxazolidine (PubChem CID 18720035) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,4-ditert-butyl-1,3-oxazolidine.

Molecular Properties

Compound Name2,4-ditert-butyl-1,3-oxazolidine
PubChem CID18720035
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,4-ditert-butyl-1,3-oxazolidine
SMILESCC(C)(C)C1COC(C(C)(C)C)N1
InChIInChI=1S/C11H23NO/c1-10(2,3)8-7-13-9(12-8)11(4,5)6/h8-9,12H,7H2,1-6H3
InChIKeyIMJOPSACTORHOD-UHFFFAOYSA-N
XLogP2.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,4-ditert-butyl-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 2,4-ditert-butyl-1,3-oxazolidine?
The IUPAC name of 2,4-ditert-butyl-1,3-oxazolidine (CID 18720035) is 2,4-ditert-butyl-1,3-oxazolidine.
What is the SMILES notation for 2,4-ditert-butyl-1,3-oxazolidine?
The canonical SMILES for 2,4-ditert-butyl-1,3-oxazolidine is CC(C)(C)C1COC(C(C)(C)C)N1.
What is the InChIKey of 2,4-ditert-butyl-1,3-oxazolidine?
The InChIKey is IMJOPSACTORHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10(2,3)8-7-13-9(12-8)11(4,5)6/h8-9,12H,7H2,1-6H3.
What are the key properties of 2,4-ditert-butyl-1,3-oxazolidine?
2,4-ditert-butyl-1,3-oxazolidine has a molecular weight of 185.31 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-1,3-oxazolidine is sourced from PubChem (CID 18720035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).