1-[3-[(E)-2-phenylethenyl]phenyl]piperazine

C18H20N2 — CID 56711809

IUPAC1-[3-[(E)-2-phenylethenyl]phenyl]piperazine
SMILESC(=C/c1cccc(N2CCNCC2)c1)\c1ccccc1
InChIInChI=1S/C18H20N2/c1-2-5-16(6-3-1)9-10-17-7-4-8-18(15-17)20-13-11-19-12-14-20/h1-10,15,19H,11-14H2/b10-9+
InChIKeyGGWCGLDPZZEVKQ-MDZDMXLPSA-N
MW264.37 g/mol
LogP3.27
Rot. Bonds3

About 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine

1-[3-[(E)-2-phenylethenyl]phenyl]piperazine (PubChem CID 56711809) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine.

Molecular Properties

Compound Name1-[3-[(E)-2-phenylethenyl]phenyl]piperazine
PubChem CID56711809
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Name1-[3-[(E)-2-phenylethenyl]phenyl]piperazine
SMILESC(=C/c1cccc(N2CCNCC2)c1)\c1ccccc1
InChIInChI=1S/C18H20N2/c1-2-5-16(6-3-1)9-10-17-7-4-8-18(15-17)20-13-11-19-12-14-20/h1-10,15,19H,11-14H2/b10-9+
InChIKeyGGWCGLDPZZEVKQ-MDZDMXLPSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine 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-[3-[(E)-2-phenylethenyl]phenyl]piperazine?
The IUPAC name of 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine (CID 56711809) is 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine.
What is the SMILES notation for 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine?
The canonical SMILES for 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine is C(=C/c1cccc(N2CCNCC2)c1)\c1ccccc1.
What is the InChIKey of 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine?
The InChIKey is GGWCGLDPZZEVKQ-MDZDMXLPSA-N. The full InChI is InChI=1S/C18H20N2/c1-2-5-16(6-3-1)9-10-17-7-4-8-18(15-17)20-13-11-19-12-14-20/h1-10,15,19H,11-14H2/b10-9+.
What are the key properties of 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine?
1-[3-[(E)-2-phenylethenyl]phenyl]piperazine has a molecular weight of 264.37 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(E)-2-phenylethenyl]phenyl]piperazine is sourced from PubChem (CID 56711809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).