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

C5H8N4O2 — CID 106396958

IUPAC2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESNCC(=O)NCc1ncon1
InChIInChI=1S/C5H8N4O2/c6-1-5(10)7-2-4-8-3-11-9-4/h3H,1-2,6H2,(H,7,10)
InChIKeyTWQMBGYPPWSSHY-UHFFFAOYSA-N
MW156.15 g/mol
LogP-1.36
Rot. Bonds3

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

2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (PubChem CID 106396958) has the molecular formula C5H8N4O2 and a molecular weight of 156.15 g/mol. Its IUPAC name is 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
PubChem CID106396958
Molecular FormulaC5H8N4O2
Molecular Weight156.15 g/mol
Exact Mass156.06
IUPAC Name2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESNCC(=O)NCc1ncon1
InChIInChI=1S/C5H8N4O2/c6-1-5(10)7-2-4-8-3-11-9-4/h3H,1-2,6H2,(H,7,10)
InChIKeyTWQMBGYPPWSSHY-UHFFFAOYSA-N
XLogP-1.36
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.15
LogP ≤ 5-1.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The IUPAC name of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (CID 106396958) is 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The canonical SMILES for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is NCC(=O)NCc1ncon1.
What is the InChIKey of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The InChIKey is TWQMBGYPPWSSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O2/c6-1-5(10)7-2-4-8-3-11-9-4/h3H,1-2,6H2,(H,7,10).
What are the key properties of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide has a molecular weight of 156.15 g/mol, XLogP of -1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is sourced from PubChem (CID 106396958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).