piperazine;hydroiodide

C4H11IN2 — CID 3018278

IUPACpiperazine;hydroiodide
SMILESC1CNCCN1.I
InChIInChI=1S/C4H10N2.HI/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H
InChIKeyMCEUCOMSCDMLPY-UHFFFAOYSA-N
MW214.05 g/mol
LogP-0.20
Rot. Bonds

About piperazine;hydroiodide

piperazine;hydroiodide (PubChem CID 3018278) has the molecular formula C4H11IN2 and a molecular weight of 214.05 g/mol. Its IUPAC name is piperazine;hydroiodide.

Molecular Properties

Compound Namepiperazine;hydroiodide
PubChem CID3018278
Molecular FormulaC4H11IN2
Molecular Weight214.05 g/mol
Exact Mass214.00
IUPAC Namepiperazine;hydroiodide
SMILESC1CNCCN1.I
InChIInChI=1S/C4H10N2.HI/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H
InChIKeyMCEUCOMSCDMLPY-UHFFFAOYSA-N
XLogP-0.20
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.05
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Piperazine
CID 4837
Diethylenetriamine
CID 8111
Piperazine Dihydrochloride
CID 8893
1-Methylpiperazine
CID 53167
Aminoethylpiperazine
CID 8795
Piperazine, hydrochloride (1:?)
CID 82044
1-Ethylpiperazine
CID 79196
Piperazine, hydrobromide (1:1)
CID 3014804
1,1-Dimethylpiperazin-1-ium chloride
CID 214727
Piperazine, hydrate (1:?)
CID 167574
Piperazine Dihydriodide
CID 20068687
Piperazine dihydrobromide
CID 3017157

Frequently Asked Questions

What is the IUPAC name of piperazine;hydroiodide?
The IUPAC name of piperazine;hydroiodide (CID 3018278) is piperazine;hydroiodide.
What is the SMILES notation for piperazine;hydroiodide?
The canonical SMILES for piperazine;hydroiodide is C1CNCCN1.I.
What is the InChIKey of piperazine;hydroiodide?
The InChIKey is MCEUCOMSCDMLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.HI/c1-2-6-4-3-5-1;/h5-6H,1-4H2;1H.
What are the key properties of piperazine;hydroiodide?
piperazine;hydroiodide has a molecular weight of 214.05 g/mol, XLogP of -0.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;hydroiodide is sourced from PubChem (CID 3018278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).