1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine

C15H24N2O — CID 82480406

IUPAC1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine
SMILESCOc1cc(C)cc(C)c1CCN1CCNCC1
InChIInChI=1S/C15H24N2O/c1-12-10-13(2)14(15(11-12)18-3)4-7-17-8-5-16-6-9-17/h10-11,16H,4-9H2,1-3H3
InChIKeyRVICJTKXPOZRCL-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.76
Rot. Bonds4

About 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine

1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine (PubChem CID 82480406) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine
PubChem CID82480406
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine
SMILESCOc1cc(C)cc(C)c1CCN1CCNCC1
InChIInChI=1S/C15H24N2O/c1-12-10-13(2)14(15(11-12)18-3)4-7-17-8-5-16-6-9-17/h10-11,16H,4-9H2,1-3H3
InChIKeyRVICJTKXPOZRCL-UHFFFAOYSA-N
XLogP1.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]-1,4-diazepane
CID 82485738
1-[2-(2,4,6-trimethylphenyl)ethyl]piperazine
CID 15391878
1-[2-(2,4-dimethoxy-3,6-dimethylphenyl)ethyl]piperazine
CID 117446675
2-[(2-methoxy-4,6-dimethylphenyl)methyl]-1-methylpiperazine
CID 116928060
1-[2-(2-methoxy-5-methylphenyl)ethyl]piperazine
CID 82083196
2,5,7-trimethyl-3-(2-piperazin-1-ylethyl)-1H-indole
CID 96679391
1-[2-(2,3,5-trimethylphenyl)ethyl]piperazine
CID 117337037
1-[2-(2-fluoro-5-methoxy-4-methylphenyl)ethyl]piperazine
CID 117384381
4-methoxy-5-methyl-2-(2-piperazin-1-ylethyl)phenol
CID 117379682
1-[2-(3-fluoro-5-methoxy-4-methylphenyl)ethyl]piperazine
CID 117384405
1-[2-(4-chloro-2-methoxy-5-methylphenyl)ethyl]piperazine
CID 82551173
1-[2-(2-ethyl-5-fluoro-3-methoxyphenyl)ethyl]piperazine
CID 117420263

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine?
The IUPAC name of 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine (CID 82480406) is 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine?
The canonical SMILES for 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine is COc1cc(C)cc(C)c1CCN1CCNCC1.
What is the InChIKey of 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine?
The InChIKey is RVICJTKXPOZRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-10-13(2)14(15(11-12)18-3)4-7-17-8-5-16-6-9-17/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine?
1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine has a molecular weight of 248.37 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine is sourced from PubChem (CID 82480406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).