2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide

C10H17N3O3 — CID 146082823

IUPAC2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(C(C)C)noc1=O
InChIInChI=1S/C10H17N3O3/c1-6(2)9-12-16-10(15)13(9)5-8(14)11-7(3)4/h6-7H,5H2,1-4H3,(H,11,14)
InChIKeyJMYBGXMVSQCBGW-UHFFFAOYSA-N
MW227.26 g/mol
LogP0.48
Rot. Bonds4

About 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide

2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide (PubChem CID 146082823) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
PubChem CID146082823
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(C(C)C)noc1=O
InChIInChI=1S/C10H17N3O3/c1-6(2)9-12-16-10(15)13(9)5-8(14)11-7(3)4/h6-7H,5H2,1-4H3,(H,11,14)
InChIKeyJMYBGXMVSQCBGW-UHFFFAOYSA-N
XLogP0.48
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-methylcyclohexyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
CID 154796898
N-methyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide
CID 146075514
N-(3-acetylphenyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
CID 146082832
2-[2-(1-chloroethyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 43667741
2-(2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylacetamide
CID 4051540
2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide
CID 53141525
N-[1-(furan-2-yl)ethyl]-2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetamide
CID 71935095
2-(5-oxo-3-pyridin-2-yl-1,2,4-oxadiazol-4-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 94813808
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]propanamide
CID 17029919
2-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1-pyridinyl]-N-propan-2-ylacetamide
CID 53141589
2-(5-amino-2-methylbenzimidazol-1-yl)-N-propan-2-ylacetamide
CID 62506711
2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
CID 17032674

Frequently Asked Questions

What is the IUPAC name of 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide (CID 146082823) is 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1c(C(C)C)noc1=O.
What is the InChIKey of 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide?
The InChIKey is JMYBGXMVSQCBGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-6(2)9-12-16-10(15)13(9)5-8(14)11-7(3)4/h6-7H,5H2,1-4H3,(H,11,14).
What are the key properties of 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide?
2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide has a molecular weight of 227.26 g/mol, XLogP of 0.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 146082823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).