N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide

C4H6N4O2 — CID 536687

IUPACN-(4-amino-1,2,5-oxadiazol-3-yl)acetamide
SMILESCC(=O)Nc1nonc1N
InChIInChI=1S/C4H6N4O2/c1-2(9)6-4-3(5)7-10-8-4/h1H3,(H2,5,7)(H,6,8,9)
InChIKeyGVZQUWHSBVLLCC-UHFFFAOYSA-N
MW142.12 g/mol
LogP-0.39
Rot. Bonds1

About N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide

N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide (PubChem CID 536687) has the molecular formula C4H6N4O2 and a molecular weight of 142.12 g/mol. Its IUPAC name is N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-amino-1,2,5-oxadiazol-3-yl)acetamide
PubChem CID536687
Molecular FormulaC4H6N4O2
Molecular Weight142.12 g/mol
Exact Mass142.05
IUPAC NameN-(4-amino-1,2,5-oxadiazol-3-yl)acetamide
SMILESCC(=O)Nc1nonc1N
InChIInChI=1S/C4H6N4O2/c1-2(9)6-4-3(5)7-10-8-4/h1H3,(H2,5,7)(H,6,8,9)
InChIKeyGVZQUWHSBVLLCC-UHFFFAOYSA-N
XLogP-0.39
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide?
The IUPAC name of N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide (CID 536687) is N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide.
What is the SMILES notation for N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide?
The canonical SMILES for N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide is CC(=O)Nc1nonc1N.
What is the InChIKey of N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide?
The InChIKey is GVZQUWHSBVLLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N4O2/c1-2(9)6-4-3(5)7-10-8-4/h1H3,(H2,5,7)(H,6,8,9).
What are the key properties of N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide?
N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide has a molecular weight of 142.12 g/mol, XLogP of -0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-1,2,5-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 536687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).