piperazine;hydrobromide

C4H11BrN2 — CID 3014804

IUPACpiperazine;hydrobromide
SMILESBr.C1CNCCN1
InChIInChI=1S/C4H10N2.BrH/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H
InChIKeyRYHBGVSBFUOHAE-UHFFFAOYSA-N
MW167.05 g/mol
LogP-0.24
Rot. Bonds

About piperazine;hydrobromide

piperazine;hydrobromide (PubChem CID 3014804) has the molecular formula C4H11BrN2 and a molecular weight of 167.05 g/mol. Its IUPAC name is piperazine;hydrobromide.

Molecular Properties

Compound Namepiperazine;hydrobromide
PubChem CID3014804
Molecular FormulaC4H11BrN2
Molecular Weight167.05 g/mol
Exact Mass166.01
IUPAC Namepiperazine;hydrobromide
SMILESBr.C1CNCCN1
InChIInChI=1S/C4H10N2.BrH/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H
InChIKeyRYHBGVSBFUOHAE-UHFFFAOYSA-N
XLogP-0.24
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.05
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of piperazine;hydrobromide?
The IUPAC name of piperazine;hydrobromide (CID 3014804) is piperazine;hydrobromide.
What is the SMILES notation for piperazine;hydrobromide?
The canonical SMILES for piperazine;hydrobromide is Br.C1CNCCN1.
What is the InChIKey of piperazine;hydrobromide?
The InChIKey is RYHBGVSBFUOHAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.BrH/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H.
What are the key properties of piperazine;hydrobromide?
piperazine;hydrobromide has a molecular weight of 167.05 g/mol, XLogP of -0.24, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;hydrobromide is sourced from PubChem (CID 3014804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).