2,6-dimethyl-1,3,5-oxadiazinan-4-one

C5H10N2O2 — CID 58880534

IUPAC2,6-dimethyl-1,3,5-oxadiazinan-4-one
SMILESCC1NC(=O)NC(C)O1
InChIInChI=1S/C5H10N2O2/c1-3-6-5(8)7-4(2)9-3/h3-4H,1-2H3,(H2,6,7,8)
InChIKeyNPQGLLXEDVWUPS-UHFFFAOYSA-N
MW130.15 g/mol
LogP0.01
Rot. Bonds

About 2,6-dimethyl-1,3,5-oxadiazinan-4-one

2,6-dimethyl-1,3,5-oxadiazinan-4-one (PubChem CID 58880534) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 2,6-dimethyl-1,3,5-oxadiazinan-4-one.

Molecular Properties

Compound Name2,6-dimethyl-1,3,5-oxadiazinan-4-one
PubChem CID58880534
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name2,6-dimethyl-1,3,5-oxadiazinan-4-one
SMILESCC1NC(=O)NC(C)O1
InChIInChI=1S/C5H10N2O2/c1-3-6-5(8)7-4(2)9-3/h3-4H,1-2H3,(H2,6,7,8)
InChIKeyNPQGLLXEDVWUPS-UHFFFAOYSA-N
XLogP0.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,6-dimethyl-1,3,5-oxadiazinan-4-one 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 2,6-dimethyl-1,3,5-oxadiazinan-4-one?
The IUPAC name of 2,6-dimethyl-1,3,5-oxadiazinan-4-one (CID 58880534) is 2,6-dimethyl-1,3,5-oxadiazinan-4-one.
What is the SMILES notation for 2,6-dimethyl-1,3,5-oxadiazinan-4-one?
The canonical SMILES for 2,6-dimethyl-1,3,5-oxadiazinan-4-one is CC1NC(=O)NC(C)O1.
What is the InChIKey of 2,6-dimethyl-1,3,5-oxadiazinan-4-one?
The InChIKey is NPQGLLXEDVWUPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-3-6-5(8)7-4(2)9-3/h3-4H,1-2H3,(H2,6,7,8).
What are the key properties of 2,6-dimethyl-1,3,5-oxadiazinan-4-one?
2,6-dimethyl-1,3,5-oxadiazinan-4-one has a molecular weight of 130.15 g/mol, XLogP of 0.01, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-1,3,5-oxadiazinan-4-one is sourced from PubChem (CID 58880534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).