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

C11H19N3O3 — CID 146082825

IUPACN,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCN(CC)C(=O)Cn1c(C(C)C)noc1=O
InChIInChI=1S/C11H19N3O3/c1-5-13(6-2)9(15)7-14-10(8(3)4)12-17-11(14)16/h8H,5-7H2,1-4H3
InChIKeyUOFJVDLQGUCZNT-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.83
Rot. Bonds5

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

N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 146082825) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
PubChem CID146082825
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC NameN,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCN(CC)C(=O)Cn1c(C(C)C)noc1=O
InChIInChI=1S/C11H19N3O3/c1-5-13(6-2)9(15)7-14-10(8(3)4)12-17-11(14)16/h8H,5-7H2,1-4H3
InChIKeyUOFJVDLQGUCZNT-UHFFFAOYSA-N
XLogP0.83
TPSA68.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide (CID 146082825) is N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is CCN(CC)C(=O)Cn1c(C(C)C)noc1=O.
What is the InChIKey of N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
The InChIKey is UOFJVDLQGUCZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-5-13(6-2)9(15)7-14-10(8(3)4)12-17-11(14)16/h8H,5-7H2,1-4H3.
What are the key properties of N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide?
N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 241.29 g/mol, XLogP of 0.83, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 146082825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).