1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine

C15H23ClN2O — CID 64933713

IUPAC1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine
SMILESCCC1CN(c2cc(Cl)ccc2OC)C(CC)CN1
InChIInChI=1S/C15H23ClN2O/c1-4-12-10-18(13(5-2)9-17-12)14-8-11(16)6-7-15(14)19-3/h6-8,12-13,17H,4-5,9-10H2,1-3H3
InChIKeyRGGQNOAUJLOFAC-UHFFFAOYSA-N
MW282.81 g/mol
LogP3.32
Rot. Bonds4

About 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine

1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine (PubChem CID 64933713) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine
PubChem CID64933713
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine
SMILESCCC1CN(c2cc(Cl)ccc2OC)C(CC)CN1
InChIInChI=1S/C15H23ClN2O/c1-4-12-10-18(13(5-2)9-17-12)14-8-11(16)6-7-15(14)19-3/h6-8,12-13,17H,4-5,9-10H2,1-3H3
InChIKeyRGGQNOAUJLOFAC-UHFFFAOYSA-N
XLogP3.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chloro-2-iodophenyl)-2,5-diethylpiperazine
CID 107640027
2-ethyl-1-(2-methoxy-5-methylphenyl)-5-propylpiperazine
CID 64931773
1-(5-chloro-2-methoxyphenyl)-2-methyl-5-propylpiperazine
CID 64933518
1-[4-chloro-2-(trifluoromethyl)phenyl]-2,5-diethylpiperazine
CID 64933723
1-(5-bromo-2-methoxyphenyl)-5-ethyl-2-methylpiperazine
CID 64946315
2-ethyl-1-(2-methoxyphenyl)-5-(2-methylpropyl)piperazine
CID 64932153
1-[1-(2,4-dichlorophenyl)ethyl]-2,5-diethylpiperazine
CID 64934081
1-[2-chloro-5-(trifluoromethyl)phenyl]-2,5-diethylpiperazine
CID 64934860
1-(5-bromo-2-methoxyphenyl)-5-ethyl-2-propan-2-ylpiperazine
CID 64946893
1-(2,5-dimethylphenyl)-2,5-diethylpiperazine
CID 64931944
1-[2-chloro-4-(trifluoromethyl)phenyl]-2,5-diethylpiperazine
CID 64941210
2-ethyl-1-(4-fluoro-2-methoxyphenyl)-5-(2-methylpropyl)piperazine
CID 64945930

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine (CID 64933713) is 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine is CCC1CN(c2cc(Cl)ccc2OC)C(CC)CN1.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine?
The InChIKey is RGGQNOAUJLOFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-4-12-10-18(13(5-2)9-17-12)14-8-11(16)6-7-15(14)19-3/h6-8,12-13,17H,4-5,9-10H2,1-3H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine?
1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine has a molecular weight of 282.81 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)-2,5-diethylpiperazine is sourced from PubChem (CID 64933713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).