N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide

C8H12N4O4 — CID 146082775

IUPACN-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCNC(=O)NC(=O)Cn1c(C)noc1=O
InChIInChI=1S/C8H12N4O4/c1-3-9-7(14)10-6(13)4-12-5(2)11-16-8(12)15/h3-4H2,1-2H3,(H2,9,10,13,14)
InChIKeyLVAJTBWTRDWZMY-UHFFFAOYSA-N
MW228.21 g/mol
LogP-1.01
Rot. Bonds3

About N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide

N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 146082775) has the molecular formula C8H12N4O4 and a molecular weight of 228.21 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
PubChem CID146082775
Molecular FormulaC8H12N4O4
Molecular Weight228.21 g/mol
Exact Mass228.09
IUPAC NameN-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCNC(=O)NC(=O)Cn1c(C)noc1=O
InChIInChI=1S/C8H12N4O4/c1-3-9-7(14)10-6(13)4-12-5(2)11-16-8(12)15/h3-4H2,1-2H3,(H2,9,10,13,14)
InChIKeyLVAJTBWTRDWZMY-UHFFFAOYSA-N
XLogP-1.01
TPSA106.23 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.21
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 130685667
4-[2-Oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-3-propan-2-yl-1,2,4-oxadiazol-5-one
CID 146093879
N-(methylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 167753366
3-Tert-butyl-4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-1,2,4-oxadiazol-5-one
CID 167920960

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide (CID 146082775) is N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide is CCNC(=O)NC(=O)Cn1c(C)noc1=O.
What is the InChIKey of N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The InChIKey is LVAJTBWTRDWZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O4/c1-3-9-7(14)10-6(13)4-12-5(2)11-16-8(12)15/h3-4H2,1-2H3,(H2,9,10,13,14).
What are the key properties of N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 228.21 g/mol, XLogP of -1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 146082775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).