2-benzyl-5-ethyl-1-methylpiperazine

C14H22N2 — CID 64843712

IUPAC2-benzyl-5-ethyl-1-methylpiperazine
SMILESCCC1CN(C)C(Cc2ccccc2)CN1
InChIInChI=1S/C14H22N2/c1-3-13-11-16(2)14(10-15-13)9-12-7-5-4-6-8-12/h4-8,13-15H,3,9-11H2,1-2H3
InChIKeyXEDBEUOYTZJFLI-UHFFFAOYSA-N
MW218.34 g/mol
LogP1.91
Rot. Bonds3

About 2-benzyl-5-ethyl-1-methylpiperazine

2-benzyl-5-ethyl-1-methylpiperazine (PubChem CID 64843712) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-benzyl-5-ethyl-1-methylpiperazine.

Molecular Properties

Compound Name2-benzyl-5-ethyl-1-methylpiperazine
PubChem CID64843712
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-benzyl-5-ethyl-1-methylpiperazine
SMILESCCC1CN(C)C(Cc2ccccc2)CN1
InChIInChI=1S/C14H22N2/c1-3-13-11-16(2)14(10-15-13)9-12-7-5-4-6-8-12/h4-8,13-15H,3,9-11H2,1-2H3
InChIKeyXEDBEUOYTZJFLI-UHFFFAOYSA-N
XLogP1.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-5-ethyl-1-methylpiperazine?
The IUPAC name of 2-benzyl-5-ethyl-1-methylpiperazine (CID 64843712) is 2-benzyl-5-ethyl-1-methylpiperazine.
What is the SMILES notation for 2-benzyl-5-ethyl-1-methylpiperazine?
The canonical SMILES for 2-benzyl-5-ethyl-1-methylpiperazine is CCC1CN(C)C(Cc2ccccc2)CN1.
What is the InChIKey of 2-benzyl-5-ethyl-1-methylpiperazine?
The InChIKey is XEDBEUOYTZJFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-13-11-16(2)14(10-15-13)9-12-7-5-4-6-8-12/h4-8,13-15H,3,9-11H2,1-2H3.
What are the key properties of 2-benzyl-5-ethyl-1-methylpiperazine?
2-benzyl-5-ethyl-1-methylpiperazine has a molecular weight of 218.34 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-5-ethyl-1-methylpiperazine is sourced from PubChem (CID 64843712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).