2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

C20H24N4 — CID 94963786

IUPAC2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1cccc2nc(Cc3ccccc3)c(CN3CCNCC3)n12
InChIInChI=1S/C20H24N4/c1-16-6-5-9-20-22-18(14-17-7-3-2-4-8-17)19(24(16)20)15-23-12-10-21-11-13-23/h2-9,21H,10-15H2,1H3
InChIKeyDXICSTGBRIZFNG-UHFFFAOYSA-N
MW320.44 g/mol
LogP2.64
Rot. Bonds4

About 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 94963786) has the molecular formula C20H24N4 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID94963786
Molecular FormulaC20H24N4
Molecular Weight320.44 g/mol
Exact Mass320.20
IUPAC Name2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1cccc2nc(Cc3ccccc3)c(CN3CCNCC3)n12
InChIInChI=1S/C20H24N4/c1-16-6-5-9-20-22-18(14-17-7-3-2-4-8-17)19(24(16)20)15-23-12-10-21-11-13-23/h2-9,21H,10-15H2,1H3
InChIKeyDXICSTGBRIZFNG-UHFFFAOYSA-N
XLogP2.64
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine 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-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine (CID 94963786) is 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is Cc1cccc2nc(Cc3ccccc3)c(CN3CCNCC3)n12.
What is the InChIKey of 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is DXICSTGBRIZFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4/c1-16-6-5-9-20-22-18(14-17-7-3-2-4-8-17)19(24(16)20)15-23-12-10-21-11-13-23/h2-9,21H,10-15H2,1H3.
What are the key properties of 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine?
2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 320.44 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-5-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 94963786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).