piperazine;pyridine;dihydrochloride

C9H17Cl2N3 — CID 175300359

IUPACpiperazine;pyridine;dihydrochloride
SMILESC1CNCCN1.Cl.Cl.c1ccncc1
InChIInChI=1S/C5H5N.C4H10N2.2ClH/c1-2-4-6-5-3-1;1-2-6-4-3-5-1;;/h1-5H;5-6H,1-4H2;2*1H
InChIKeyUWZBSKSTJMBNSB-UHFFFAOYSA-N
MW238.16 g/mol
LogP1.10
Rot. Bonds

About piperazine;pyridine;dihydrochloride

piperazine;pyridine;dihydrochloride (PubChem CID 175300359) has the molecular formula C9H17Cl2N3 and a molecular weight of 238.16 g/mol. Its IUPAC name is piperazine;pyridine;dihydrochloride.

Molecular Properties

Compound Namepiperazine;pyridine;dihydrochloride
PubChem CID175300359
Molecular FormulaC9H17Cl2N3
Molecular Weight238.16 g/mol
Exact Mass237.08
IUPAC Namepiperazine;pyridine;dihydrochloride
SMILESC1CNCCN1.Cl.Cl.c1ccncc1
InChIInChI=1S/C5H5N.C4H10N2.2ClH/c1-2-4-6-5-3-1;1-2-6-4-3-5-1;;/h1-5H;5-6H,1-4H2;2*1H
InChIKeyUWZBSKSTJMBNSB-UHFFFAOYSA-N
XLogP1.10
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.16
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of piperazine;pyridine;dihydrochloride?
The IUPAC name of piperazine;pyridine;dihydrochloride (CID 175300359) is piperazine;pyridine;dihydrochloride.
What is the SMILES notation for piperazine;pyridine;dihydrochloride?
The canonical SMILES for piperazine;pyridine;dihydrochloride is C1CNCCN1.Cl.Cl.c1ccncc1.
What is the InChIKey of piperazine;pyridine;dihydrochloride?
The InChIKey is UWZBSKSTJMBNSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H10N2.2ClH/c1-2-4-6-5-3-1;1-2-6-4-3-5-1;;/h1-5H;5-6H,1-4H2;2*1H.
What are the key properties of piperazine;pyridine;dihydrochloride?
piperazine;pyridine;dihydrochloride has a molecular weight of 238.16 g/mol, XLogP of 1.10, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;pyridine;dihydrochloride is sourced from PubChem (CID 175300359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).