2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide

C10H17N3O3 — CID 103943217

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide
SMILESCC(C)(C)OCC(=O)NCCc1ncno1
InChIInChI=1S/C10H17N3O3/c1-10(2,3)15-6-8(14)11-5-4-9-12-7-13-16-9/h7H,4-6H2,1-3H3,(H,11,14)
InChIKeyKDKLALCRMAIVBT-UHFFFAOYSA-N
MW227.26 g/mol
LogP0.54
Rot. Bonds5

About 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide

2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide (PubChem CID 103943217) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide
PubChem CID103943217
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide
SMILESCC(C)(C)OCC(=O)NCCc1ncno1
InChIInChI=1S/C10H17N3O3/c1-10(2,3)15-6-8(14)11-5-4-9-12-7-13-16-9/h7H,4-6H2,1-3H3,(H,11,14)
InChIKeyKDKLALCRMAIVBT-UHFFFAOYSA-N
XLogP0.54
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide (CID 103943217) is 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide is CC(C)(C)OCC(=O)NCCc1ncno1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide?
The InChIKey is KDKLALCRMAIVBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-10(2,3)15-6-8(14)11-5-4-9-12-7-13-16-9/h7H,4-6H2,1-3H3,(H,11,14).
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide has a molecular weight of 227.26 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide is sourced from PubChem (CID 103943217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).