(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine

C11H23NO — CID 129405495

IUPAC(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine
SMILESCCCCN1CCO[C@@H]1CC(C)C
InChIInChI=1S/C11H23NO/c1-4-5-6-12-7-8-13-11(12)9-10(2)3/h10-11H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyBXEMOWKMFUWRPI-LLVKDONJSA-N
MW185.31 g/mol
LogP2.49
Rot. Bonds5

About (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine

(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine (PubChem CID 129405495) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine.

Molecular Properties

Compound Name(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine
PubChem CID129405495
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine
SMILESCCCCN1CCO[C@@H]1CC(C)C
InChIInChI=1S/C11H23NO/c1-4-5-6-12-7-8-13-11(12)9-10(2)3/h10-11H,4-9H2,1-3H3/t11-/m1/s1
InChIKeyBXEMOWKMFUWRPI-LLVKDONJSA-N
XLogP2.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2R)-3-butyl-2-(2-methylpropyl)-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 (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine?
The IUPAC name of (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine (CID 129405495) is (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine.
What is the SMILES notation for (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine?
The canonical SMILES for (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine is CCCCN1CCO[C@@H]1CC(C)C.
What is the InChIKey of (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine?
The InChIKey is BXEMOWKMFUWRPI-LLVKDONJSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-5-6-12-7-8-13-11(12)9-10(2)3/h10-11H,4-9H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine?
(2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine has a molecular weight of 185.31 g/mol, XLogP of 2.49, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-butyl-2-(2-methylpropyl)-1,3-oxazolidine is sourced from PubChem (CID 129405495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).