1-(2-pyrazol-1-ylethyl)piperazine

C9H16N4 — CID 22321757

IUPAC1-(2-pyrazol-1-ylethyl)piperazine
SMILESc1cnn(CCN2CCNCC2)c1
InChIInChI=1S/C9H16N4/c1-2-11-13(5-1)9-8-12-6-3-10-4-7-12/h1-2,5,10H,3-4,6-9H2
InChIKeyZPTBMAUXTXJLDH-UHFFFAOYSA-N
MW180.26 g/mol
LogP-0.21
Rot. Bonds3

About 1-(2-pyrazol-1-ylethyl)piperazine

1-(2-pyrazol-1-ylethyl)piperazine (PubChem CID 22321757) has the molecular formula C9H16N4 and a molecular weight of 180.26 g/mol. Its IUPAC name is 1-(2-pyrazol-1-ylethyl)piperazine.

Molecular Properties

Compound Name1-(2-pyrazol-1-ylethyl)piperazine
PubChem CID22321757
Molecular FormulaC9H16N4
Molecular Weight180.26 g/mol
Exact Mass180.14
IUPAC Name1-(2-pyrazol-1-ylethyl)piperazine
SMILESc1cnn(CCN2CCNCC2)c1
InChIInChI=1S/C9H16N4/c1-2-11-13(5-1)9-8-12-6-3-10-4-7-12/h1-2,5,10H,3-4,6-9H2
InChIKeyZPTBMAUXTXJLDH-UHFFFAOYSA-N
XLogP-0.21
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.26
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-pyrazol-1-ylethyl)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-(2-pyrazol-1-ylethyl)piperazine?
The IUPAC name of 1-(2-pyrazol-1-ylethyl)piperazine (CID 22321757) is 1-(2-pyrazol-1-ylethyl)piperazine.
What is the SMILES notation for 1-(2-pyrazol-1-ylethyl)piperazine?
The canonical SMILES for 1-(2-pyrazol-1-ylethyl)piperazine is c1cnn(CCN2CCNCC2)c1.
What is the InChIKey of 1-(2-pyrazol-1-ylethyl)piperazine?
The InChIKey is ZPTBMAUXTXJLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-2-11-13(5-1)9-8-12-6-3-10-4-7-12/h1-2,5,10H,3-4,6-9H2.
What are the key properties of 1-(2-pyrazol-1-ylethyl)piperazine?
1-(2-pyrazol-1-ylethyl)piperazine has a molecular weight of 180.26 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrazol-1-ylethyl)piperazine is sourced from PubChem (CID 22321757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).