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

C16H10ClFN4O — CID 46949520

IUPAC2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole
SMILESFc1c(-c2nnc(Cc3ccccc3)o2)nc2ccc(Cl)cn12
InChIInChI=1S/C16H10ClFN4O/c17-11-6-7-12-19-14(15(18)22(12)9-11)16-21-20-13(23-16)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChIKeyNQEDOCMGHBSCFP-UHFFFAOYSA-N
MW328.73 g/mol
LogP3.77
Rot. Bonds3

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

2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole (PubChem CID 46949520) has the molecular formula C16H10ClFN4O and a molecular weight of 328.73 g/mol. Its IUPAC name is 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole
PubChem CID46949520
Molecular FormulaC16H10ClFN4O
Molecular Weight328.73 g/mol
Exact Mass328.05
IUPAC Name2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole
SMILESFc1c(-c2nnc(Cc3ccccc3)o2)nc2ccc(Cl)cn12
InChIInChI=1S/C16H10ClFN4O/c17-11-6-7-12-19-14(15(18)22(12)9-11)16-21-20-13(23-16)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChIKeyNQEDOCMGHBSCFP-UHFFFAOYSA-N
XLogP3.77
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.73
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole
CID 46949521
2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-[(4-chlorophenyl)methyl]-1,3,4-oxadiazole
CID 99962961
2-benzyl-5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,3,4-oxadiazole
CID 40583538
6-chloro-3-[(4-methylphenyl)methyl]-2-phenylimidazo[1,2-a]pyridine
CID 46904877
6-chloro-3-[(3-fluorophenyl)methyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 51360074
[6-chloro-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 39132848
2-(5-benzyl-1,3,4-oxadiazol-2-yl)-6-bromo-5-(trifluoromethyl)pyridin-3-amine
CID 71515696
2-benzyl-5-pyridin-2-yl-1,3,4-oxadiazole
CID 156786960
2-benzyl-5-[3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 141083060
7-[5-[(4-fluorophenyl)methyl]-1,3,4-oxadiazol-2-yl]-1,6-naphthyridin-8-ol
CID 135524880
2-[(4-chlorophenyl)methyl]-5-(1-methylpyrazol-4-yl)-1,3,4-oxadiazole
CID 19585229
6-chloro-2-(2-chloro-6-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617429

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole (CID 46949520) is 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole is Fc1c(-c2nnc(Cc3ccccc3)o2)nc2ccc(Cl)cn12.
What is the InChIKey of 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole?
The InChIKey is NQEDOCMGHBSCFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFN4O/c17-11-6-7-12-19-14(15(18)22(12)9-11)16-21-20-13(23-16)8-10-4-2-1-3-5-10/h1-7,9H,8H2.
What are the key properties of 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole?
2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole has a molecular weight of 328.73 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-5-(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 46949520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).