2-benzyl-1,5-dimethylpiperazine

C13H20N2 — CID 64844005

IUPAC2-benzyl-1,5-dimethylpiperazine
SMILESCC1CN(C)C(Cc2ccccc2)CN1
InChIInChI=1S/C13H20N2/c1-11-10-15(2)13(9-14-11)8-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3
InChIKeyRBJGTNLLRAUFMO-UHFFFAOYSA-N
MW204.32 g/mol
LogP1.52
Rot. Bonds2

About 2-benzyl-1,5-dimethylpiperazine

2-benzyl-1,5-dimethylpiperazine (PubChem CID 64844005) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 2-benzyl-1,5-dimethylpiperazine.

Molecular Properties

Compound Name2-benzyl-1,5-dimethylpiperazine
PubChem CID64844005
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name2-benzyl-1,5-dimethylpiperazine
SMILESCC1CN(C)C(Cc2ccccc2)CN1
InChIInChI=1S/C13H20N2/c1-11-10-15(2)13(9-14-11)8-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3
InChIKeyRBJGTNLLRAUFMO-UHFFFAOYSA-N
XLogP1.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1,5-dimethylpiperazine?
The IUPAC name of 2-benzyl-1,5-dimethylpiperazine (CID 64844005) is 2-benzyl-1,5-dimethylpiperazine.
What is the SMILES notation for 2-benzyl-1,5-dimethylpiperazine?
The canonical SMILES for 2-benzyl-1,5-dimethylpiperazine is CC1CN(C)C(Cc2ccccc2)CN1.
What is the InChIKey of 2-benzyl-1,5-dimethylpiperazine?
The InChIKey is RBJGTNLLRAUFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-11-10-15(2)13(9-14-11)8-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3.
What are the key properties of 2-benzyl-1,5-dimethylpiperazine?
2-benzyl-1,5-dimethylpiperazine has a molecular weight of 204.32 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1,5-dimethylpiperazine is sourced from PubChem (CID 64844005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).