2-(3-methoxyphenyl)piperazine

C11H16N2O — CID 4252767

IUPAC2-(3-methoxyphenyl)piperazine
SMILESCOc1cccc(C2CNCCN2)c1
InChIInChI=1S/C11H16N2O/c1-14-10-4-2-3-9(7-10)11-8-12-5-6-13-11/h2-4,7,11-13H,5-6,8H2,1H3
InChIKeySAQIBFOALNPYFY-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.93
Rot. Bonds2

About 2-(3-methoxyphenyl)piperazine

2-(3-methoxyphenyl)piperazine (PubChem CID 4252767) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)piperazine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)piperazine
PubChem CID4252767
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(3-methoxyphenyl)piperazine
SMILESCOc1cccc(C2CNCCN2)c1
InChIInChI=1S/C11H16N2O/c1-14-10-4-2-3-9(7-10)11-8-12-5-6-13-11/h2-4,7,11-13H,5-6,8H2,1H3
InChIKeySAQIBFOALNPYFY-UHFFFAOYSA-N
XLogP0.93
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)piperazine?
The IUPAC name of 2-(3-methoxyphenyl)piperazine (CID 4252767) is 2-(3-methoxyphenyl)piperazine.
What is the SMILES notation for 2-(3-methoxyphenyl)piperazine?
The canonical SMILES for 2-(3-methoxyphenyl)piperazine is COc1cccc(C2CNCCN2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)piperazine?
The InChIKey is SAQIBFOALNPYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-14-10-4-2-3-9(7-10)11-8-12-5-6-13-11/h2-4,7,11-13H,5-6,8H2,1H3.
What are the key properties of 2-(3-methoxyphenyl)piperazine?
2-(3-methoxyphenyl)piperazine has a molecular weight of 192.26 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)piperazine is sourced from PubChem (CID 4252767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).