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

C7H11N3O3 — CID 130685667

IUPACN-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCNC(=O)Cn1c(C)noc1=O
InChIInChI=1S/C7H11N3O3/c1-3-8-6(11)4-10-5(2)9-13-7(10)12/h3-4H2,1-2H3,(H,8,11)
InChIKeyDUBAABAVHJBXKV-UHFFFAOYSA-N
MW185.18 g/mol
LogP-0.72
Rot. Bonds3

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

N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide (PubChem CID 130685667) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
PubChem CID130685667
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC NameN-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
SMILESCCNC(=O)Cn1c(C)noc1=O
InChIInChI=1S/C7H11N3O3/c1-3-8-6(11)4-10-5(2)9-13-7(10)12/h3-4H2,1-2H3,(H,8,11)
InChIKeyDUBAABAVHJBXKV-UHFFFAOYSA-N
XLogP-0.72
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-oxo-N-propan-2-yl-4H-1,2,4-oxadiazole-3-carboxamide
CID 137225636
N-ethyl-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137232774
5-Oxo-4-propan-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 124704699
N,N-dimethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 130710694
N-ethyl-N-methyl-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137216584
N-butan-2-yl-5-oxo-4H-1,2,4-oxadiazole-3-carboxamide
CID 137243240
2-(3-tert-butyl-5-oxo-1,2,4-oxadiazol-4-yl)-N-ethylacetamide
CID 146082711
N-butyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 146082714
N-(ethylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 146082775
2-(3-tert-butyl-5-oxo-1,2,4-oxadiazol-4-yl)-N-methylacetamide
CID 154810400
N-(methylcarbamoyl)-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide
CID 167753366

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The IUPAC name of N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide (CID 130685667) is N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide.
What is the SMILES notation for N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The canonical SMILES for N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide is CCNC(=O)Cn1c(C)noc1=O.
What is the InChIKey of N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
The InChIKey is DUBAABAVHJBXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c1-3-8-6(11)4-10-5(2)9-13-7(10)12/h3-4H2,1-2H3,(H,8,11).
What are the key properties of N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide?
N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide has a molecular weight of 185.18 g/mol, XLogP of -0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methyl-5-oxo-1,2,4-oxadiazol-4-yl)acetamide is sourced from PubChem (CID 130685667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).