1-(3-pyridin-3-ylphenyl)piperazine

C15H17N3 — CID 150431219

IUPAC1-(3-pyridin-3-ylphenyl)piperazine
SMILESc1cncc(-c2cccc(N3CCNCC3)c2)c1
InChIInChI=1S/C15H17N3/c1-3-13(14-4-2-6-17-12-14)11-15(5-1)18-9-7-16-8-10-18/h1-6,11-12,16H,7-10H2
InChIKeyHJUWRYQSBMJBQN-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.16
Rot. Bonds2

About 1-(3-pyridin-3-ylphenyl)piperazine

1-(3-pyridin-3-ylphenyl)piperazine (PubChem CID 150431219) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-(3-pyridin-3-ylphenyl)piperazine.

Molecular Properties

Compound Name1-(3-pyridin-3-ylphenyl)piperazine
PubChem CID150431219
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name1-(3-pyridin-3-ylphenyl)piperazine
SMILESc1cncc(-c2cccc(N3CCNCC3)c2)c1
InChIInChI=1S/C15H17N3/c1-3-13(14-4-2-6-17-12-14)11-15(5-1)18-9-7-16-8-10-18/h1-6,11-12,16H,7-10H2
InChIKeyHJUWRYQSBMJBQN-UHFFFAOYSA-N
XLogP2.16
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-pyridin-3-ylphenyl)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-pyridin-3-ylphenyl)piperazine?
The IUPAC name of 1-(3-pyridin-3-ylphenyl)piperazine (CID 150431219) is 1-(3-pyridin-3-ylphenyl)piperazine.
What is the SMILES notation for 1-(3-pyridin-3-ylphenyl)piperazine?
The canonical SMILES for 1-(3-pyridin-3-ylphenyl)piperazine is c1cncc(-c2cccc(N3CCNCC3)c2)c1.
What is the InChIKey of 1-(3-pyridin-3-ylphenyl)piperazine?
The InChIKey is HJUWRYQSBMJBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-3-13(14-4-2-6-17-12-14)11-15(5-1)18-9-7-16-8-10-18/h1-6,11-12,16H,7-10H2.
What are the key properties of 1-(3-pyridin-3-ylphenyl)piperazine?
1-(3-pyridin-3-ylphenyl)piperazine has a molecular weight of 239.32 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-pyridin-3-ylphenyl)piperazine is sourced from PubChem (CID 150431219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).