2,3-dimethyl-1,3-oxazinane

C6H13NO — CID 567613

IUPAC2,3-dimethyl-1,3-oxazinane
SMILESCC1OCCCN1C
InChIInChI=1S/C6H13NO/c1-6-7(2)4-3-5-8-6/h6H,3-5H2,1-2H3
InChIKeyKOJAVKVQILIJRN-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.68
Rot. Bonds

About 2,3-dimethyl-1,3-oxazinane

2,3-dimethyl-1,3-oxazinane (PubChem CID 567613) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2,3-dimethyl-1,3-oxazinane.

Molecular Properties

Compound Name2,3-dimethyl-1,3-oxazinane
PubChem CID567613
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2,3-dimethyl-1,3-oxazinane
SMILESCC1OCCCN1C
InChIInChI=1S/C6H13NO/c1-6-7(2)4-3-5-8-6/h6H,3-5H2,1-2H3
InChIKeyKOJAVKVQILIJRN-UHFFFAOYSA-N
XLogP0.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-dimethyl-1,3-oxazinane 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 2,3-dimethyl-1,3-oxazinane?
The IUPAC name of 2,3-dimethyl-1,3-oxazinane (CID 567613) is 2,3-dimethyl-1,3-oxazinane.
What is the SMILES notation for 2,3-dimethyl-1,3-oxazinane?
The canonical SMILES for 2,3-dimethyl-1,3-oxazinane is CC1OCCCN1C.
What is the InChIKey of 2,3-dimethyl-1,3-oxazinane?
The InChIKey is KOJAVKVQILIJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-6-7(2)4-3-5-8-6/h6H,3-5H2,1-2H3.
What are the key properties of 2,3-dimethyl-1,3-oxazinane?
2,3-dimethyl-1,3-oxazinane has a molecular weight of 115.18 g/mol, XLogP of 0.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1,3-oxazinane is sourced from PubChem (CID 567613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).