1-piperazin-1-ylpiperazine

C8H18N4 — CID 15130624

IUPAC1-piperazin-1-ylpiperazine
SMILESC1CN(N2CCNCC2)CCN1
InChIInChI=1S/C8H18N4/c1-5-11(6-2-9-1)12-7-3-10-4-8-12/h9-10H,1-8H2
InChIKeyHSXGVUKUWYPECQ-UHFFFAOYSA-N
MW170.26 g/mol
LogP-1.29
Rot. Bonds1

About 1-piperazin-1-ylpiperazine

1-piperazin-1-ylpiperazine (PubChem CID 15130624) has the molecular formula C8H18N4 and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-piperazin-1-ylpiperazine.

Molecular Properties

Compound Name1-piperazin-1-ylpiperazine
PubChem CID15130624
Molecular FormulaC8H18N4
Molecular Weight170.26 g/mol
Exact Mass170.15
IUPAC Name1-piperazin-1-ylpiperazine
SMILESC1CN(N2CCNCC2)CCN1
InChIInChI=1S/C8H18N4/c1-5-11(6-2-9-1)12-7-3-10-4-8-12/h9-10H,1-8H2
InChIKeyHSXGVUKUWYPECQ-UHFFFAOYSA-N
XLogP-1.29
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-piperazin-1-ylpiperazine?
The IUPAC name of 1-piperazin-1-ylpiperazine (CID 15130624) is 1-piperazin-1-ylpiperazine.
What is the SMILES notation for 1-piperazin-1-ylpiperazine?
The canonical SMILES for 1-piperazin-1-ylpiperazine is C1CN(N2CCNCC2)CCN1.
What is the InChIKey of 1-piperazin-1-ylpiperazine?
The InChIKey is HSXGVUKUWYPECQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4/c1-5-11(6-2-9-1)12-7-3-10-4-8-12/h9-10H,1-8H2.
What are the key properties of 1-piperazin-1-ylpiperazine?
1-piperazin-1-ylpiperazine has a molecular weight of 170.26 g/mol, XLogP of -1.29, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperazin-1-ylpiperazine is sourced from PubChem (CID 15130624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).