2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide

C13H15N3O3 — CID 25284079

IUPAC2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide
SMILESCCc1nnc(-c2cccc(OCC(=O)NC)c2)o1
InChIInChI=1S/C13H15N3O3/c1-3-12-15-16-13(19-12)9-5-4-6-10(7-9)18-8-11(17)14-2/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKeyKYGSTYUUFWAGHL-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.42
Rot. Bonds5

About 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide

2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide (PubChem CID 25284079) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide.

Molecular Properties

Compound Name2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide
PubChem CID25284079
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide
SMILESCCc1nnc(-c2cccc(OCC(=O)NC)c2)o1
InChIInChI=1S/C13H15N3O3/c1-3-12-15-16-13(19-12)9-5-4-6-10(7-9)18-8-11(17)14-2/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKeyKYGSTYUUFWAGHL-UHFFFAOYSA-N
XLogP1.42
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide?
The IUPAC name of 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide (CID 25284079) is 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide.
What is the SMILES notation for 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide?
The canonical SMILES for 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide is CCc1nnc(-c2cccc(OCC(=O)NC)c2)o1.
What is the InChIKey of 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide?
The InChIKey is KYGSTYUUFWAGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-3-12-15-16-13(19-12)9-5-4-6-10(7-9)18-8-11(17)14-2/h4-7H,3,8H2,1-2H3,(H,14,17).
What are the key properties of 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide?
2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide has a molecular weight of 261.28 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(5-ethyl-1,3,4-oxadiazol-2-yl)phenoxy]-N-methylacetamide is sourced from PubChem (CID 25284079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).