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

C4H10N2O — CID 20583502

IUPAC3,4-dimethyl-1,2,5-oxadiazolidine
SMILESCC1NONC1C
InChIInChI=1S/C4H10N2O/c1-3-4(2)6-7-5-3/h3-6H,1-2H3
InChIKeyXLISEHBWCORBDB-UHFFFAOYSA-N
MW102.14 g/mol
LogP-0.20
Rot. Bonds

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

3,4-dimethyl-1,2,5-oxadiazolidine (PubChem CID 20583502) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is 3,4-dimethyl-1,2,5-oxadiazolidine.

Molecular Properties

Compound Name3,4-dimethyl-1,2,5-oxadiazolidine
PubChem CID20583502
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Name3,4-dimethyl-1,2,5-oxadiazolidine
SMILESCC1NONC1C
InChIInChI=1S/C4H10N2O/c1-3-4(2)6-7-5-3/h3-6H,1-2H3
InChIKeyXLISEHBWCORBDB-UHFFFAOYSA-N
XLogP-0.20
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-1,2,5-oxadiazolidine?
The IUPAC name of 3,4-dimethyl-1,2,5-oxadiazolidine (CID 20583502) is 3,4-dimethyl-1,2,5-oxadiazolidine.
What is the SMILES notation for 3,4-dimethyl-1,2,5-oxadiazolidine?
The canonical SMILES for 3,4-dimethyl-1,2,5-oxadiazolidine is CC1NONC1C.
What is the InChIKey of 3,4-dimethyl-1,2,5-oxadiazolidine?
The InChIKey is XLISEHBWCORBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O/c1-3-4(2)6-7-5-3/h3-6H,1-2H3.
What are the key properties of 3,4-dimethyl-1,2,5-oxadiazolidine?
3,4-dimethyl-1,2,5-oxadiazolidine has a molecular weight of 102.14 g/mol, XLogP of -0.20, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1,2,5-oxadiazolidine is sourced from PubChem (CID 20583502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).