2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine

C11H18N2O3 — CID 162491525

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine
SMILESCc1noc(C)c1N1OC(C)(C)C(C)(C)O1
InChIInChI=1S/C11H18N2O3/c1-7-9(8(2)14-12-7)13-15-10(3,4)11(5,6)16-13/h1-6H3
InChIKeyWWLVOYFNABRNGE-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.53
Rot. Bonds1

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine

2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine (PubChem CID 162491525) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine
PubChem CID162491525
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine
SMILESCc1noc(C)c1N1OC(C)(C)C(C)(C)O1
InChIInChI=1S/C11H18N2O3/c1-7-9(8(2)14-12-7)13-15-10(3,4)11(5,6)16-13/h1-6H3
InChIKeyWWLVOYFNABRNGE-UHFFFAOYSA-N
XLogP2.53
TPSA47.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine (CID 162491525) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine is Cc1noc(C)c1N1OC(C)(C)C(C)(C)O1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine?
The InChIKey is WWLVOYFNABRNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-7-9(8(2)14-12-7)13-15-10(3,4)11(5,6)16-13/h1-6H3.
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine has a molecular weight of 226.28 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxazolidine is sourced from PubChem (CID 162491525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).