1-(2,5-dimethoxyphenyl)-2-methylpiperazine

C13H20N2O2 — CID 64938786

IUPAC1-(2,5-dimethoxyphenyl)-2-methylpiperazine
SMILESCOc1ccc(OC)c(N2CCNCC2C)c1
InChIInChI=1S/C13H20N2O2/c1-10-9-14-6-7-15(10)12-8-11(16-2)4-5-13(12)17-3/h4-5,8,10,14H,6-7,9H2,1-3H3
InChIKeyUORBRAZSLKSXJF-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.50
Rot. Bonds3

About 1-(2,5-dimethoxyphenyl)-2-methylpiperazine

1-(2,5-dimethoxyphenyl)-2-methylpiperazine (PubChem CID 64938786) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(2,5-dimethoxyphenyl)-2-methylpiperazine.

Molecular Properties

Compound Name1-(2,5-dimethoxyphenyl)-2-methylpiperazine
PubChem CID64938786
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-(2,5-dimethoxyphenyl)-2-methylpiperazine
SMILESCOc1ccc(OC)c(N2CCNCC2C)c1
InChIInChI=1S/C13H20N2O2/c1-10-9-14-6-7-15(10)12-8-11(16-2)4-5-13(12)17-3/h4-5,8,10,14H,6-7,9H2,1-3H3
InChIKeyUORBRAZSLKSXJF-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,5-dimethoxyphenyl)-2-methylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethoxyphenyl)-2-methylpiperazine?
The IUPAC name of 1-(2,5-dimethoxyphenyl)-2-methylpiperazine (CID 64938786) is 1-(2,5-dimethoxyphenyl)-2-methylpiperazine.
What is the SMILES notation for 1-(2,5-dimethoxyphenyl)-2-methylpiperazine?
The canonical SMILES for 1-(2,5-dimethoxyphenyl)-2-methylpiperazine is COc1ccc(OC)c(N2CCNCC2C)c1.
What is the InChIKey of 1-(2,5-dimethoxyphenyl)-2-methylpiperazine?
The InChIKey is UORBRAZSLKSXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-9-14-6-7-15(10)12-8-11(16-2)4-5-13(12)17-3/h4-5,8,10,14H,6-7,9H2,1-3H3.
What are the key properties of 1-(2,5-dimethoxyphenyl)-2-methylpiperazine?
1-(2,5-dimethoxyphenyl)-2-methylpiperazine has a molecular weight of 236.31 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethoxyphenyl)-2-methylpiperazine is sourced from PubChem (CID 64938786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).