1,4-dioxine;piperazine

C8H14N2O2 — CID 156540252

IUPAC1,4-dioxine;piperazine
SMILESC1=COC=CO1.C1CNCCN1
InChIInChI=1S/C4H10N2.C4H4O2/c2*1-2-6-4-3-5-1/h5-6H,1-4H2;1-4H
InChIKeyWGKLRGLDJHUNFE-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.15
Rot. Bonds

About 1,4-dioxine;piperazine

1,4-dioxine;piperazine (PubChem CID 156540252) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 1,4-dioxine;piperazine.

Molecular Properties

Compound Name1,4-dioxine;piperazine
PubChem CID156540252
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name1,4-dioxine;piperazine
SMILESC1=COC=CO1.C1CNCCN1
InChIInChI=1S/C4H10N2.C4H4O2/c2*1-2-6-4-3-5-1/h5-6H,1-4H2;1-4H
InChIKeyWGKLRGLDJHUNFE-UHFFFAOYSA-N
XLogP0.15
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,4-dioxine;piperazine?
The IUPAC name of 1,4-dioxine;piperazine (CID 156540252) is 1,4-dioxine;piperazine.
What is the SMILES notation for 1,4-dioxine;piperazine?
The canonical SMILES for 1,4-dioxine;piperazine is C1=COC=CO1.C1CNCCN1.
What is the InChIKey of 1,4-dioxine;piperazine?
The InChIKey is WGKLRGLDJHUNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.C4H4O2/c2*1-2-6-4-3-5-1/h5-6H,1-4H2;1-4H.
What are the key properties of 1,4-dioxine;piperazine?
1,4-dioxine;piperazine has a molecular weight of 170.21 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dioxine;piperazine is sourced from PubChem (CID 156540252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).