2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole

C12H11ClN4OS — CID 163297350

IUPAC2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole
SMILESCCSc1nnc(-c2c(C)nc3ccc(Cl)cn23)o1
InChIInChI=1S/C12H11ClN4OS/c1-3-19-12-16-15-11(18-12)10-7(2)14-9-5-4-8(13)6-17(9)10/h4-6H,3H2,1-2H3
InChIKeyRBRGRCHHAQRAGP-UHFFFAOYSA-N
MW294.77 g/mol
LogP3.46
Rot. Bonds3

About 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole

2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole (PubChem CID 163297350) has the molecular formula C12H11ClN4OS and a molecular weight of 294.77 g/mol. Its IUPAC name is 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole
PubChem CID163297350
Molecular FormulaC12H11ClN4OS
Molecular Weight294.77 g/mol
Exact Mass294.03
IUPAC Name2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole
SMILESCCSc1nnc(-c2c(C)nc3ccc(Cl)cn23)o1
InChIInChI=1S/C12H11ClN4OS/c1-3-19-12-16-15-11(18-12)10-7(2)14-9-5-4-8(13)6-17(9)10/h4-6H,3H2,1-2H3
InChIKeyRBRGRCHHAQRAGP-UHFFFAOYSA-N
XLogP3.46
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.77
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole?
The IUPAC name of 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole (CID 163297350) is 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole is CCSc1nnc(-c2c(C)nc3ccc(Cl)cn23)o1.
What is the InChIKey of 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole?
The InChIKey is RBRGRCHHAQRAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN4OS/c1-3-19-12-16-15-11(18-12)10-7(2)14-9-5-4-8(13)6-17(9)10/h4-6H,3H2,1-2H3.
What are the key properties of 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole?
2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole has a molecular weight of 294.77 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-ethylsulfanyl-1,3,4-oxadiazole is sourced from PubChem (CID 163297350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).