4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide

C14H8N4O3 — CID 5083852

IUPAC4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESN#Cc1ccc(C(=O)Nc2nnc(-c3ccco3)o2)cc1
InChIInChI=1S/C14H8N4O3/c15-8-9-3-5-10(6-4-9)12(19)16-14-18-17-13(21-14)11-2-1-7-20-11/h1-7H,(H,16,18,19)
InChIKeyRVWFSJZIICQXGC-UHFFFAOYSA-N
MW280.24 g/mol
LogP2.45
Rot. Bonds3

About 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide

4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide (PubChem CID 5083852) has the molecular formula C14H8N4O3 and a molecular weight of 280.24 g/mol. Its IUPAC name is 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide.

Molecular Properties

Compound Name4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
PubChem CID5083852
Molecular FormulaC14H8N4O3
Molecular Weight280.24 g/mol
Exact Mass280.06
IUPAC Name4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
SMILESN#Cc1ccc(C(=O)Nc2nnc(-c3ccco3)o2)cc1
InChIInChI=1S/C14H8N4O3/c15-8-9-3-5-10(6-4-9)12(19)16-14-18-17-13(21-14)11-2-1-7-20-11/h1-7H,(H,16,18,19)
InChIKeyRVWFSJZIICQXGC-UHFFFAOYSA-N
XLogP2.45
TPSA104.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.24
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 5223276
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 2566808
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]pentanamide
CID 4062264
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenylacetamide
CID 4154351
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)cyclopropanecarboxamide
CID 4536914
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-2-phenoxyacetamide
CID 4581041
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)cinnamamide
CID 6265754
N-[5-(2,4-dimethylphenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide
CID 7244050
[2-Oxo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)amino]ethyl] furan-2-carboxylate
CID 7814111
N-(5-(furan-2-yl)-1,3,4-oxadiazol-2-yl)-3-methylbenzamide
CID 4462598
N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]acetamide
CID 4245856
2-(3-((3-(5-(Furan-2-Yl)-1,3,4-Oxadiazol-2-Yl)ureido)methyl)phenoxy)acetic Acid
CID 70680427

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide?
The IUPAC name of 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide (CID 5083852) is 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide.
What is the SMILES notation for 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide?
The canonical SMILES for 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide is N#Cc1ccc(C(=O)Nc2nnc(-c3ccco3)o2)cc1.
What is the InChIKey of 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide?
The InChIKey is RVWFSJZIICQXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N4O3/c15-8-9-3-5-10(6-4-9)12(19)16-14-18-17-13(21-14)11-2-1-7-20-11/h1-7H,(H,16,18,19).
What are the key properties of 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide?
4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide has a molecular weight of 280.24 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]benzamide is sourced from PubChem (CID 5083852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).