2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide

C11H12N4O2S — CID 5226770

IUPAC2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide
SMILESCCc1nnc(SCC(=O)Nc2ccccn2)o1
InChIInChI=1S/C11H12N4O2S/c1-2-10-14-15-11(17-10)18-7-9(16)13-8-5-3-4-6-12-8/h3-6H,2,7H2,1H3,(H,12,13,16)
InChIKeyYXEKJILAPDCJHG-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.76
Rot. Bonds5

About 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide

2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide (PubChem CID 5226770) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide.

Molecular Properties

Compound Name2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide
PubChem CID5226770
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Name2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide
SMILESCCc1nnc(SCC(=O)Nc2ccccn2)o1
InChIInChI=1S/C11H12N4O2S/c1-2-10-14-15-11(17-10)18-7-9(16)13-8-5-3-4-6-12-8/h3-6H,2,7H2,1H3,(H,12,13,16)
InChIKeyYXEKJILAPDCJHG-UHFFFAOYSA-N
XLogP1.76
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide?
The IUPAC name of 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide (CID 5226770) is 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide.
What is the SMILES notation for 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide?
The canonical SMILES for 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide is CCc1nnc(SCC(=O)Nc2ccccn2)o1.
What is the InChIKey of 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide?
The InChIKey is YXEKJILAPDCJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-2-10-14-15-11(17-10)18-7-9(16)13-8-5-3-4-6-12-8/h3-6H,2,7H2,1H3,(H,12,13,16).
What are the key properties of 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide?
2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide has a molecular weight of 264.31 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide is sourced from PubChem (CID 5226770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).