ethane;ethene;piperazine

C8H20N2 — CID 153373897

IUPACethane;ethene;piperazine
SMILESC1CNCCN1.C=C.CC
InChIInChI=1S/C4H10N2.C2H6.C2H4/c1-2-6-4-3-5-1;2*1-2/h5-6H,1-4H2;1-2H3;1-2H2
InChIKeyKGSIPEHZGGPMQF-UHFFFAOYSA-N
MW144.26 g/mol
LogP1.01
Rot. Bonds

About ethane;ethene;piperazine

ethane;ethene;piperazine (PubChem CID 153373897) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is ethane;ethene;piperazine.

Molecular Properties

Compound Nameethane;ethene;piperazine
PubChem CID153373897
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Nameethane;ethene;piperazine
SMILESC1CNCCN1.C=C.CC
InChIInChI=1S/C4H10N2.C2H6.C2H4/c1-2-6-4-3-5-1;2*1-2/h5-6H,1-4H2;1-2H3;1-2H2
InChIKeyKGSIPEHZGGPMQF-UHFFFAOYSA-N
XLogP1.01
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;ethene;piperazine?
The IUPAC name of ethane;ethene;piperazine (CID 153373897) is ethane;ethene;piperazine.
What is the SMILES notation for ethane;ethene;piperazine?
The canonical SMILES for ethane;ethene;piperazine is C1CNCCN1.C=C.CC.
What is the InChIKey of ethane;ethene;piperazine?
The InChIKey is KGSIPEHZGGPMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.C2H6.C2H4/c1-2-6-4-3-5-1;2*1-2/h5-6H,1-4H2;1-2H3;1-2H2.
What are the key properties of ethane;ethene;piperazine?
ethane;ethene;piperazine has a molecular weight of 144.26 g/mol, XLogP of 1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;piperazine is sourced from PubChem (CID 153373897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).