5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride

C14H17ClN6O — CID 120957845

IUPAC5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
SMILESCN1CCNCC1c1noc(-c2ccc3nccn3c2)n1.Cl
InChIInChI=1S/C14H16N6O.ClH/c1-19-6-4-15-8-11(19)13-17-14(21-18-13)10-2-3-12-16-5-7-20(12)9-10;/h2-3,5,7,9,11,15H,4,6,8H2,1H3;1H
InChIKeyNIQFKCZNIPWXHL-UHFFFAOYSA-N
MW320.78 g/mol
LogP1.38
Rot. Bonds2

About 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride

5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride (PubChem CID 120957845) has the molecular formula C14H17ClN6O and a molecular weight of 320.78 g/mol. Its IUPAC name is 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride.

Molecular Properties

Compound Name5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
PubChem CID120957845
Molecular FormulaC14H17ClN6O
Molecular Weight320.78 g/mol
Exact Mass320.12
IUPAC Name5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
SMILESCN1CCNCC1c1noc(-c2ccc3nccn3c2)n1.Cl
InChIInChI=1S/C14H16N6O.ClH/c1-19-6-4-15-8-11(19)13-17-14(21-18-13)10-2-3-12-16-5-7-20(12)9-10;/h2-3,5,7,9,11,15H,4,6,8H2,1H3;1H
InChIKeyNIQFKCZNIPWXHL-UHFFFAOYSA-N
XLogP1.38
TPSA71.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.78
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride with MolForge

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Related Compounds

5-(4-iodophenyl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120957632
5-(4-bromophenyl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120957626
5-[4-(1,3-dithian-2-yl)phenyl]-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
CID 120958918
3-(1-methylpiperazin-2-yl)-5-(6-pyrrolidin-1-yl-3-pyridinyl)-1,2,4-oxadiazole
CID 120957840
3-(1-methylpiperazin-2-yl)-5-(4-propylphenyl)-1,2,4-oxadiazole;hydrochloride
CID 120957261
3-(1-methylpiperazin-2-yl)-5-[4-(5-methylpyrazol-1-yl)phenyl]-1,2,4-oxadiazole;hydrochloride
CID 120960454
3-(1-methylpiperazin-2-yl)-5-[4-(methylsulfanylmethyl)phenyl]-1,2,4-oxadiazole;hydrochloride
CID 120955943
5-(1,3-dihydro-2-benzofuran-5-yl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
CID 120961614
3-(1-methylpiperazin-2-yl)-5-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole;hydrochloride
CID 120960614
3-(1-methylpiperazin-2-yl)-5-[3-(1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazole;hydrochloride
CID 120961460
3-(1-methylpiperazin-2-yl)-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,4-oxadiazole
CID 120958353
3-(1-methylpiperazin-2-yl)-5-quinolin-8-yl-1,2,4-oxadiazole
CID 120956638

Frequently Asked Questions

What is the IUPAC name of 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride?
The IUPAC name of 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride (CID 120957845) is 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride.
What is the SMILES notation for 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride?
The canonical SMILES for 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride is CN1CCNCC1c1noc(-c2ccc3nccn3c2)n1.Cl.
What is the InChIKey of 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride?
The InChIKey is NIQFKCZNIPWXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O.ClH/c1-19-6-4-15-8-11(19)13-17-14(21-18-13)10-2-3-12-16-5-7-20(12)9-10;/h2-3,5,7,9,11,15H,4,6,8H2,1H3;1H.
What are the key properties of 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride?
5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride has a molecular weight of 320.78 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imidazo[1,2-a]pyridin-6-yl-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride is sourced from PubChem (CID 120957845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).