2-methyl-1,4-bis(prop-2-enyl)piperazine

C11H20N2 — CID 517346

IUPAC2-methyl-1,4-bis(prop-2-enyl)piperazine
SMILESC=CCN1CCN(CC=C)C(C)C1
InChIInChI=1S/C11H20N2/c1-4-6-12-8-9-13(7-5-2)11(3)10-12/h4-5,11H,1-2,6-10H2,3H3
InChIKeyBVKMZBVEMNMKPR-UHFFFAOYSA-N
MW180.29 g/mol
LogP1.36
Rot. Bonds4

About 2-methyl-1,4-bis(prop-2-enyl)piperazine

2-methyl-1,4-bis(prop-2-enyl)piperazine (PubChem CID 517346) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2-methyl-1,4-bis(prop-2-enyl)piperazine.

Molecular Properties

Compound Name2-methyl-1,4-bis(prop-2-enyl)piperazine
PubChem CID517346
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2-methyl-1,4-bis(prop-2-enyl)piperazine
SMILESC=CCN1CCN(CC=C)C(C)C1
InChIInChI=1S/C11H20N2/c1-4-6-12-8-9-13(7-5-2)11(3)10-12/h4-5,11H,1-2,6-10H2,3H3
InChIKeyBVKMZBVEMNMKPR-UHFFFAOYSA-N
XLogP1.36
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.36
H-Bond Donors ≤ 50
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 2-methyl-1,4-bis(prop-2-enyl)piperazine?
The IUPAC name of 2-methyl-1,4-bis(prop-2-enyl)piperazine (CID 517346) is 2-methyl-1,4-bis(prop-2-enyl)piperazine.
What is the SMILES notation for 2-methyl-1,4-bis(prop-2-enyl)piperazine?
The canonical SMILES for 2-methyl-1,4-bis(prop-2-enyl)piperazine is C=CCN1CCN(CC=C)C(C)C1.
What is the InChIKey of 2-methyl-1,4-bis(prop-2-enyl)piperazine?
The InChIKey is BVKMZBVEMNMKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-4-6-12-8-9-13(7-5-2)11(3)10-12/h4-5,11H,1-2,6-10H2,3H3.
What are the key properties of 2-methyl-1,4-bis(prop-2-enyl)piperazine?
2-methyl-1,4-bis(prop-2-enyl)piperazine has a molecular weight of 180.29 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,4-bis(prop-2-enyl)piperazine is sourced from PubChem (CID 517346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).