2,3,4-trimethyl-1,2,5-oxadiazolidine

C5H12N2O — CID 123333529

IUPAC2,3,4-trimethyl-1,2,5-oxadiazolidine
SMILESCC1NON(C)C1C
InChIInChI=1S/C5H12N2O/c1-4-5(2)7(3)8-6-4/h4-6H,1-3H3
InChIKeyQFUNNJWFQLNTIM-UHFFFAOYSA-N
MW116.16 g/mol
LogP0.14
Rot. Bonds

About 2,3,4-trimethyl-1,2,5-oxadiazolidine

2,3,4-trimethyl-1,2,5-oxadiazolidine (PubChem CID 123333529) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is 2,3,4-trimethyl-1,2,5-oxadiazolidine.

Molecular Properties

Compound Name2,3,4-trimethyl-1,2,5-oxadiazolidine
PubChem CID123333529
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name2,3,4-trimethyl-1,2,5-oxadiazolidine
SMILESCC1NON(C)C1C
InChIInChI=1S/C5H12N2O/c1-4-5(2)7(3)8-6-4/h4-6H,1-3H3
InChIKeyQFUNNJWFQLNTIM-UHFFFAOYSA-N
XLogP0.14
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-1,2,5-oxadiazolidine?
The IUPAC name of 2,3,4-trimethyl-1,2,5-oxadiazolidine (CID 123333529) is 2,3,4-trimethyl-1,2,5-oxadiazolidine.
What is the SMILES notation for 2,3,4-trimethyl-1,2,5-oxadiazolidine?
The canonical SMILES for 2,3,4-trimethyl-1,2,5-oxadiazolidine is CC1NON(C)C1C.
What is the InChIKey of 2,3,4-trimethyl-1,2,5-oxadiazolidine?
The InChIKey is QFUNNJWFQLNTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-4-5(2)7(3)8-6-4/h4-6H,1-3H3.
What are the key properties of 2,3,4-trimethyl-1,2,5-oxadiazolidine?
2,3,4-trimethyl-1,2,5-oxadiazolidine has a molecular weight of 116.16 g/mol, XLogP of 0.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-1,2,5-oxadiazolidine is sourced from PubChem (CID 123333529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).