N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide

C6H9N3O2 — CID 103677635

IUPACN-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ncon1
InChIInChI=1S/C6H9N3O2/c1-5(10)7-3-2-6-8-4-11-9-6/h4H,2-3H2,1H3,(H,7,10)
InChIKeyNAFJWAOEZQSWIB-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.25
Rot. Bonds3

About N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide

N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide (PubChem CID 103677635) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide
PubChem CID103677635
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC NameN-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCc1ncon1
InChIInChI=1S/C6H9N3O2/c1-5(10)7-3-2-6-8-4-11-9-6/h4H,2-3H2,1H3,(H,7,10)
InChIKeyNAFJWAOEZQSWIB-UHFFFAOYSA-N
XLogP-0.25
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide?
The IUPAC name of N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide (CID 103677635) is N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide is CC(=O)NCCc1ncon1.
What is the InChIKey of N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide?
The InChIKey is NAFJWAOEZQSWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-5(10)7-3-2-6-8-4-11-9-6/h4H,2-3H2,1H3,(H,7,10).
What are the key properties of N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide?
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide has a molecular weight of 155.16 g/mol, XLogP of -0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2,4-oxadiazol-3-yl)ethyl]acetamide is sourced from PubChem (CID 103677635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).