2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole

C16H9Cl2FN4O — CID 46949521

IUPAC2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole
SMILESFc1c(-c2nnc(Cc3ccc(Cl)cc3)o2)nc2ccc(Cl)cn12
InChIInChI=1S/C16H9Cl2FN4O/c17-10-3-1-9(2-4-10)7-13-21-22-16(24-13)14-15(19)23-8-11(18)5-6-12(23)20-14/h1-6,8H,7H2
InChIKeyXVJYBUYKHDADKO-UHFFFAOYSA-N
MW363.18 g/mol
LogP4.42
Rot. Bonds3

About 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole

2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole (PubChem CID 46949521) has the molecular formula C16H9Cl2FN4O and a molecular weight of 363.18 g/mol. Its IUPAC name is 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole
PubChem CID46949521
Molecular FormulaC16H9Cl2FN4O
Molecular Weight363.18 g/mol
Exact Mass362.01
IUPAC Name2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole
SMILESFc1c(-c2nnc(Cc3ccc(Cl)cc3)o2)nc2ccc(Cl)cn12
InChIInChI=1S/C16H9Cl2FN4O/c17-10-3-1-9(2-4-10)7-13-21-22-16(24-13)14-15(19)23-8-11(18)5-6-12(23)20-14/h1-6,8H,7H2
InChIKeyXVJYBUYKHDADKO-UHFFFAOYSA-N
XLogP4.42
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.18
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole?
The IUPAC name of 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole (CID 46949521) is 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole is Fc1c(-c2nnc(Cc3ccc(Cl)cc3)o2)nc2ccc(Cl)cn12.
What is the InChIKey of 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole?
The InChIKey is XVJYBUYKHDADKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9Cl2FN4O/c17-10-3-1-9(2-4-10)7-13-21-22-16(24-13)14-15(19)23-8-11(18)5-6-12(23)20-14/h1-6,8H,7H2.
What are the key properties of 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole?
2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole has a molecular weight of 363.18 g/mol, XLogP of 4.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole is sourced from PubChem (CID 46949521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).