2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine

C17H28N2O — CID 64931773

IUPAC2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine
SMILESCCCC1CN(c2cc(C)ccc2OC)C(CC)CN1
InChIInChI=1S/C17H28N2O/c1-5-7-14-12-19(15(6-2)11-18-14)16-10-13(3)8-9-17(16)20-4/h8-10,14-15,18H,5-7,11-12H2,1-4H3
InChIKeyWTTQIGORVFDXLU-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.36
Rot. Bonds5

About 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine

2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine (PubChem CID 64931773) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine
PubChem CID64931773
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine
SMILESCCCC1CN(c2cc(C)ccc2OC)C(CC)CN1
InChIInChI=1S/C17H28N2O/c1-5-7-14-12-19(15(6-2)11-18-14)16-10-13(3)8-9-17(16)20-4/h8-10,14-15,18H,5-7,11-12H2,1-4H3
InChIKeyWTTQIGORVFDXLU-UHFFFAOYSA-N
XLogP3.36
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-bromo-5-methylphenyl)-2-ethyl-5-propylpiperazine
CID 82758286
2-ethyl-1-[(2-methoxy-5-methylphenyl)methyl]-5-propylpiperazine
CID 64845190
1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine
CID 64933713
1-(2,5-dimethylphenyl)-2,5-diethylpiperazine
CID 64931944
1-(2-methoxy-5-methylphenyl)-3-propylpiperazine
CID 64923794
1-(5-chloro-2-methoxyphenyl)-2-methyl-5-propylpiperazine
CID 64933518
1-(2-fluoro-5-methylphenyl)-2-methyl-5-propylpiperazine
CID 64933636
2-ethyl-5-propyl-1-(2-propylphenyl)piperazine
CID 64946303
2-ethyl-1-(2-methoxyphenyl)-5-(2-methylpropyl)piperazine
CID 64932153
1-(4-bromo-2-ethylphenyl)-2-ethyl-5-propylpiperazine
CID 81289528
1-(3,5-dichloro-4-fluorophenyl)-2-ethyl-5-propylpiperazine
CID 107579958
1-(3,4-difluorophenyl)-2-ethyl-5-propylpiperazine
CID 64930823

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine?
The IUPAC name of 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine (CID 64931773) is 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine.
What is the SMILES notation for 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine?
The canonical SMILES for 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine is CCCC1CN(c2cc(C)ccc2OC)C(CC)CN1.
What is the InChIKey of 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine?
The InChIKey is WTTQIGORVFDXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-7-14-12-19(15(6-2)11-18-14)16-10-13(3)8-9-17(16)20-4/h8-10,14-15,18H,5-7,11-12H2,1-4H3.
What are the key properties of 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine?
2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine has a molecular weight of 276.42 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine is sourced from PubChem (CID 64931773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).