4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide

C15H9N5O2 — CID 4097143

IUPAC4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
SMILESN#Cc1ccc(C(=O)Nc2nnc(-c3ccccn3)o2)cc1
InChIInChI=1S/C15H9N5O2/c16-9-10-4-6-11(7-5-10)13(21)18-15-20-19-14(22-15)12-3-1-2-8-17-12/h1-8H,(H,18,20,21)
InChIKeyVROSEKICHDIJFW-UHFFFAOYSA-N
MW291.27 g/mol
LogP2.26
Rot. Bonds3

About 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide

4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 4097143) has the molecular formula C15H9N5O2 and a molecular weight of 291.27 g/mol. Its IUPAC name is 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
PubChem CID4097143
Molecular FormulaC15H9N5O2
Molecular Weight291.27 g/mol
Exact Mass291.08
IUPAC Name4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
SMILESN#Cc1ccc(C(=O)Nc2nnc(-c3ccccn3)o2)cc1
InChIInChI=1S/C15H9N5O2/c16-9-10-4-6-11(7-5-10)13(21)18-15-20-19-14(22-15)12-3-1-2-8-17-12/h1-8H,(H,18,20,21)
InChIKeyVROSEKICHDIJFW-UHFFFAOYSA-N
XLogP2.26
TPSA104.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.27
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-methyl-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 3397365
N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 7100780
3-bromo-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 4296584
2-fluoro-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 3463675
3-chloro-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 4056807
4-((3-methylpiperidin-1-yl)sulfonyl)-N-(5-(pyridin-2-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4109598
4-bromo-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 5057534
4-Methyl-N-[5-(pyridin-4-YL)-1,3,4-oxadiazol-2-YL]benzamide
CID 5175267
5-(4-pyridin-3-yl-2-pyridinyl)-N-[4-(pyrrolidin-1-ylmethyl)phenyl]-1,3,4-oxadiazol-2-amine
CID 137660432
2-methyl-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 3463672
4-((2-methylpiperidin-1-yl)sulfonyl)-N-(5-(pyridin-2-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 3345839
N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 4084501

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide (CID 4097143) is 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide is N#Cc1ccc(C(=O)Nc2nnc(-c3ccccn3)o2)cc1.
What is the InChIKey of 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is VROSEKICHDIJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N5O2/c16-9-10-4-6-11(7-5-10)13(21)18-15-20-19-14(22-15)12-3-1-2-8-17-12/h1-8H,(H,18,20,21).
What are the key properties of 4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide?
4-cyano-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 291.27 g/mol, XLogP of 2.26, 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-pyridin-2-yl-1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 4097143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).