5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine

C17H28N2O — CID 64848203

IUPAC5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine
SMILESCCCC1CNC(Cc2ccccc2)CN1CCOC
InChIInChI=1S/C17H28N2O/c1-3-7-17-13-18-16(14-19(17)10-11-20-2)12-15-8-5-4-6-9-15/h4-6,8-9,16-18H,3,7,10-14H2,1-2H3
InChIKeyOYENADILTMBMED-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.32
Rot. Bonds7

About 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine

5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine (PubChem CID 64848203) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine.

Molecular Properties

Compound Name5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine
PubChem CID64848203
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine
SMILESCCCC1CNC(Cc2ccccc2)CN1CCOC
InChIInChI=1S/C17H28N2O/c1-3-7-17-13-18-16(14-19(17)10-11-20-2)12-15-8-5-4-6-9-15/h4-6,8-9,16-18H,3,7,10-14H2,1-2H3
InChIKeyOYENADILTMBMED-UHFFFAOYSA-N
XLogP2.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine?
The IUPAC name of 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine (CID 64848203) is 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine.
What is the SMILES notation for 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine?
The canonical SMILES for 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine is CCCC1CNC(Cc2ccccc2)CN1CCOC.
What is the InChIKey of 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine?
The InChIKey is OYENADILTMBMED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-3-7-17-13-18-16(14-19(17)10-11-20-2)12-15-8-5-4-6-9-15/h4-6,8-9,16-18H,3,7,10-14H2,1-2H3.
What are the key properties of 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine?
5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine has a molecular weight of 276.42 g/mol, XLogP of 2.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-1-(2-methoxyethyl)-2-propylpiperazine is sourced from PubChem (CID 64848203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).