5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride

C18H23Cl2N5 — CID 120755583

IUPAC5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride
SMILESCc1cccc2nc(CN3CCNCC3c3cccnc3)cn12.Cl.Cl
InChIInChI=1S/C18H21N5.2ClH/c1-14-4-2-6-18-21-16(13-23(14)18)12-22-9-8-20-11-17(22)15-5-3-7-19-10-15;;/h2-7,10,13,17,20H,8-9,11-12H2,1H3;2*1H
InChIKeyAIOFWTWOIFLWDO-UHFFFAOYSA-N
MW380.32 g/mol
LogP3.03
Rot. Bonds3

About 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride

5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride (PubChem CID 120755583) has the molecular formula C18H23Cl2N5 and a molecular weight of 380.32 g/mol. Its IUPAC name is 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride.

Molecular Properties

Compound Name5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride
PubChem CID120755583
Molecular FormulaC18H23Cl2N5
Molecular Weight380.32 g/mol
Exact Mass379.13
IUPAC Name5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride
SMILESCc1cccc2nc(CN3CCNCC3c3cccnc3)cn12.Cl.Cl
InChIInChI=1S/C18H21N5.2ClH/c1-14-4-2-6-18-21-16(13-23(14)18)12-22-9-8-20-11-17(22)15-5-3-7-19-10-15;;/h2-7,10,13,17,20H,8-9,11-12H2,1H3;2*1H
InChIKeyAIOFWTWOIFLWDO-UHFFFAOYSA-N
XLogP3.03
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.32
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2,6-dimethylphenyl)methyl]-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754734
2-pyridin-3-yl-1-(pyridin-2-ylmethyl)piperazine;hydrochloride
CID 120768365
4-[(2-pyridin-3-ylpiperazin-1-yl)methyl]thiadiazole;hydrochloride
CID 120767683
(7S)-1-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-7-phenyl-1,4-diazepan-5-one
CID 95054928
3-[(2-pyridin-3-ylpiperazin-1-yl)methyl]-1,2-oxazole;hydrochloride
CID 120755446
1-[(4-fluorophenyl)methyl]-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754578
5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]-1,3-oxazole;dihydrochloride
CID 120754848
2-pyridin-3-yl-1-(pyridin-4-ylmethyl)piperazine
CID 120768078
1-[(4-methoxyphenyl)methyl]-2-pyridin-3-ylpiperazine
CID 120768234
2-pyridin-3-yl-1-[(2,4,5-trimethylphenyl)methyl]piperazine
CID 120768364
5-cyclopropyl-3-[(2-pyridin-3-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazole;hydrochloride
CID 120755250
1-[(5-fluoro-2-methylphenyl)methyl]-2-pyridin-3-ylpiperazine;hydrochloride
CID 120768241

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride?
The IUPAC name of 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride (CID 120755583) is 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride.
What is the SMILES notation for 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride?
The canonical SMILES for 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride is Cc1cccc2nc(CN3CCNCC3c3cccnc3)cn12.Cl.Cl.
What is the InChIKey of 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride?
The InChIKey is AIOFWTWOIFLWDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5.2ClH/c1-14-4-2-6-18-21-16(13-23(14)18)12-22-9-8-20-11-17(22)15-5-3-7-19-10-15;;/h2-7,10,13,17,20H,8-9,11-12H2,1H3;2*1H.
What are the key properties of 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride?
5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride has a molecular weight of 380.32 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(2-pyridin-3-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine;dihydrochloride is sourced from PubChem (CID 120755583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).