2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole

C16H9F2N5O — CID 53183274

IUPAC2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole
SMILESFc1ccc(-c2nnc(-c3ccc(-n4ccnc4)nc3)o2)c(F)c1
InChIInChI=1S/C16H9F2N5O/c17-11-2-3-12(13(18)7-11)16-22-21-15(24-16)10-1-4-14(20-8-10)23-6-5-19-9-23/h1-9H
InChIKeyNADUXDAAARLXLM-UHFFFAOYSA-N
MW325.28 g/mol
LogP3.26
Rot. Bonds3

About 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole

2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole (PubChem CID 53183274) has the molecular formula C16H9F2N5O and a molecular weight of 325.28 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole
PubChem CID53183274
Molecular FormulaC16H9F2N5O
Molecular Weight325.28 g/mol
Exact Mass325.08
IUPAC Name2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole
SMILESFc1ccc(-c2nnc(-c3ccc(-n4ccnc4)nc3)o2)c(F)c1
InChIInChI=1S/C16H9F2N5O/c17-11-2-3-12(13(18)7-11)16-22-21-15(24-16)10-1-4-14(20-8-10)23-6-5-19-9-23/h1-9H
InChIKeyNADUXDAAARLXLM-UHFFFAOYSA-N
XLogP3.26
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.28
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-ethyl-5-(6-imidazol-1-yl-3-pyridinyl)-1,2,4-oxadiazole
CID 75528009
5-(2,4-difluorophenyl)-3-(6-pyrazol-1-yl-3-pyridinyl)-1,2,4-oxadiazole
CID 53171732
6-imidazol-1-yl-N-propylpyridin-3-amine
CID 43710767
N-[(4,5-dibromofuran-2-yl)methyl]-6-imidazol-1-ylpyridin-3-amine
CID 62083420
2-[2-fluoro-4-(2-propan-2-ylphenyl)phenyl]-5-(6-pyridin-2-yl-3-pyridinyl)-1,3,4-oxadiazole
CID 177181316
N-tert-butyl-6-imidazol-1-ylpyridin-3-amine
CID 167253831
3-(6-imidazol-1-yl-3-pyridinyl)-5-(5-methylthiophen-2-yl)-1,2,4-oxadiazole
CID 53171763
1-[(4-fluorophenyl)methyl]-3-[(6-imidazol-1-yl-3-pyridinyl)methyl]urea
CID 38205199
3-(6-imidazol-1-yl-3-pyridinyl)-5-(3-methoxyphenyl)-1,2,4-oxadiazole
CID 53171748
6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine
CID 43710701
5-fluoro-2-(6-imidazol-1-yl-3-pyridinyl)-7,7a-dihydro-1H-indole
CID 143915083
2-[6-(2,4-difluorophenyl)-2-pyridinyl]-5-[3-[5-[6-(2,4-difluorophenyl)-2-pyridinyl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 59236809

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole?
The IUPAC name of 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole (CID 53183274) is 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole is Fc1ccc(-c2nnc(-c3ccc(-n4ccnc4)nc3)o2)c(F)c1.
What is the InChIKey of 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole?
The InChIKey is NADUXDAAARLXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9F2N5O/c17-11-2-3-12(13(18)7-11)16-22-21-15(24-16)10-1-4-14(20-8-10)23-6-5-19-9-23/h1-9H.
What are the key properties of 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole?
2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole has a molecular weight of 325.28 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-5-(6-imidazol-1-yl-3-pyridinyl)-1,3,4-oxadiazole is sourced from PubChem (CID 53183274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).