2-piperazin-1-yl-1,2-dihydroquinoxaline

C12H16N4 — CID 91422374

IUPAC2-piperazin-1-yl-1,2-dihydroquinoxaline
SMILESC1=Nc2ccccc2NC1N1CCNCC1
InChIInChI=1S/C12H16N4/c1-2-4-11-10(3-1)14-9-12(15-11)16-7-5-13-6-8-16/h1-4,9,12-13,15H,5-8H2
InChIKeyKPGVGIQLQUGHIY-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.05
Rot. Bonds1

About 2-piperazin-1-yl-1,2-dihydroquinoxaline

2-piperazin-1-yl-1,2-dihydroquinoxaline (PubChem CID 91422374) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-piperazin-1-yl-1,2-dihydroquinoxaline.

Molecular Properties

Compound Name2-piperazin-1-yl-1,2-dihydroquinoxaline
PubChem CID91422374
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-piperazin-1-yl-1,2-dihydroquinoxaline
SMILESC1=Nc2ccccc2NC1N1CCNCC1
InChIInChI=1S/C12H16N4/c1-2-4-11-10(3-1)14-9-12(15-11)16-7-5-13-6-8-16/h1-4,9,12-13,15H,5-8H2
InChIKeyKPGVGIQLQUGHIY-UHFFFAOYSA-N
XLogP1.05
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-piperazin-1-yl-1,2-dihydroquinoxaline 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 2-piperazin-1-yl-1,2-dihydroquinoxaline?
The IUPAC name of 2-piperazin-1-yl-1,2-dihydroquinoxaline (CID 91422374) is 2-piperazin-1-yl-1,2-dihydroquinoxaline.
What is the SMILES notation for 2-piperazin-1-yl-1,2-dihydroquinoxaline?
The canonical SMILES for 2-piperazin-1-yl-1,2-dihydroquinoxaline is C1=Nc2ccccc2NC1N1CCNCC1.
What is the InChIKey of 2-piperazin-1-yl-1,2-dihydroquinoxaline?
The InChIKey is KPGVGIQLQUGHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-2-4-11-10(3-1)14-9-12(15-11)16-7-5-13-6-8-16/h1-4,9,12-13,15H,5-8H2.
What are the key properties of 2-piperazin-1-yl-1,2-dihydroquinoxaline?
2-piperazin-1-yl-1,2-dihydroquinoxaline has a molecular weight of 216.29 g/mol, XLogP of 1.05, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-1,2-dihydroquinoxaline is sourced from PubChem (CID 91422374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).