2-(2-phenylethyl)piperazine;dihydrochloride

C12H20Cl2N2 — CID 67602755

IUPAC2-(2-phenylethyl)piperazine;dihydrochloride
SMILESCl.Cl.c1ccc(CCC2CNCCN2)cc1
InChIInChI=1S/C12H18N2.2ClH/c1-2-4-11(5-3-1)6-7-12-10-13-8-9-14-12;;/h1-5,12-14H,6-10H2;2*1H
InChIKeyGNCMVWAICYVFJG-UHFFFAOYSA-N
MW263.21 g/mol
LogP2.02
Rot. Bonds3

About 2-(2-phenylethyl)piperazine;dihydrochloride

2-(2-phenylethyl)piperazine;dihydrochloride (PubChem CID 67602755) has the molecular formula C12H20Cl2N2 and a molecular weight of 263.21 g/mol. Its IUPAC name is 2-(2-phenylethyl)piperazine;dihydrochloride.

Molecular Properties

Compound Name2-(2-phenylethyl)piperazine;dihydrochloride
PubChem CID67602755
Molecular FormulaC12H20Cl2N2
Molecular Weight263.21 g/mol
Exact Mass262.10
IUPAC Name2-(2-phenylethyl)piperazine;dihydrochloride
SMILESCl.Cl.c1ccc(CCC2CNCCN2)cc1
InChIInChI=1S/C12H18N2.2ClH/c1-2-4-11(5-3-1)6-7-12-10-13-8-9-14-12;;/h1-5,12-14H,6-10H2;2*1H
InChIKeyGNCMVWAICYVFJG-UHFFFAOYSA-N
XLogP2.02
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.21
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethyl)piperazine;dihydrochloride?
The IUPAC name of 2-(2-phenylethyl)piperazine;dihydrochloride (CID 67602755) is 2-(2-phenylethyl)piperazine;dihydrochloride.
What is the SMILES notation for 2-(2-phenylethyl)piperazine;dihydrochloride?
The canonical SMILES for 2-(2-phenylethyl)piperazine;dihydrochloride is Cl.Cl.c1ccc(CCC2CNCCN2)cc1.
What is the InChIKey of 2-(2-phenylethyl)piperazine;dihydrochloride?
The InChIKey is GNCMVWAICYVFJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2.2ClH/c1-2-4-11(5-3-1)6-7-12-10-13-8-9-14-12;;/h1-5,12-14H,6-10H2;2*1H.
What are the key properties of 2-(2-phenylethyl)piperazine;dihydrochloride?
2-(2-phenylethyl)piperazine;dihydrochloride has a molecular weight of 263.21 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethyl)piperazine;dihydrochloride is sourced from PubChem (CID 67602755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).