ethane;4-methylidene-1,3,5-oxadiazinane

C6H14N2O — CID 90736678

IUPACethane;4-methylidene-1,3,5-oxadiazinane
SMILESC=C1NCOCN1.CC
InChIInChI=1S/C4H8N2O.C2H6/c1-4-5-2-7-3-6-4;1-2/h5-6H,1-3H2;1-2H3
InChIKeyAABBIRMHHWAQAJ-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.61
Rot. Bonds

About ethane;4-methylidene-1,3,5-oxadiazinane

ethane;4-methylidene-1,3,5-oxadiazinane (PubChem CID 90736678) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is ethane;4-methylidene-1,3,5-oxadiazinane.

Molecular Properties

Compound Nameethane;4-methylidene-1,3,5-oxadiazinane
PubChem CID90736678
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Nameethane;4-methylidene-1,3,5-oxadiazinane
SMILESC=C1NCOCN1.CC
InChIInChI=1S/C4H8N2O.C2H6/c1-4-5-2-7-3-6-4;1-2/h5-6H,1-3H2;1-2H3
InChIKeyAABBIRMHHWAQAJ-UHFFFAOYSA-N
XLogP0.61
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze ethane;4-methylidene-1,3,5-oxadiazinane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N'-(methoxymethyl)-1-N,1-N'-dimethylethene-1,1-diamine
CID 18740880
1-N,1-N'-bis(methoxymethyl)ethene-1,1-diamine
CID 58672103
4-Methylidene-1,3,5-oxadiazinane
CID 59114500
3-Methyl-4-methylidene-1,3,5-oxadiazinane
CID 59164371
1,3-Bis(methoxymethyl)-2-methylidene-1,3,5-triazinane
CID 89197973
3-Methyl-2-methylidene-1,3,5-oxadiazinane
CID 89936537
Ethane;2-methylidene-1,3,5-triazinane
CID 91247448

Frequently Asked Questions

What is the IUPAC name of ethane;4-methylidene-1,3,5-oxadiazinane?
The IUPAC name of ethane;4-methylidene-1,3,5-oxadiazinane (CID 90736678) is ethane;4-methylidene-1,3,5-oxadiazinane.
What is the SMILES notation for ethane;4-methylidene-1,3,5-oxadiazinane?
The canonical SMILES for ethane;4-methylidene-1,3,5-oxadiazinane is C=C1NCOCN1.CC.
What is the InChIKey of ethane;4-methylidene-1,3,5-oxadiazinane?
The InChIKey is AABBIRMHHWAQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O.C2H6/c1-4-5-2-7-3-6-4;1-2/h5-6H,1-3H2;1-2H3.
What are the key properties of ethane;4-methylidene-1,3,5-oxadiazinane?
ethane;4-methylidene-1,3,5-oxadiazinane has a molecular weight of 130.19 g/mol, XLogP of 0.61, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methylidene-1,3,5-oxadiazinane is sourced from PubChem (CID 90736678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).