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

C6H10N4O2 — CID 106396962

IUPAC2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESCNCC(=O)NCc1ncon1
InChIInChI=1S/C6H10N4O2/c1-7-3-6(11)8-2-5-9-4-12-10-5/h4,7H,2-3H2,1H3,(H,8,11)
InChIKeyJIHLNXVKWNOAMB-UHFFFAOYSA-N
MW170.17 g/mol
LogP-1.09
Rot. Bonds4

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

2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (PubChem CID 106396962) has the molecular formula C6H10N4O2 and a molecular weight of 170.17 g/mol. Its IUPAC name is 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
PubChem CID106396962
Molecular FormulaC6H10N4O2
Molecular Weight170.17 g/mol
Exact Mass170.08
IUPAC Name2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESCNCC(=O)NCc1ncon1
InChIInChI=1S/C6H10N4O2/c1-7-3-6(11)8-2-5-9-4-12-10-5/h4,7H,2-3H2,1H3,(H,8,11)
InChIKeyJIHLNXVKWNOAMB-UHFFFAOYSA-N
XLogP-1.09
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-1.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (CID 106396962) is 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is CNCC(=O)NCc1ncon1.
What is the InChIKey of 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The InChIKey is JIHLNXVKWNOAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2/c1-7-3-6(11)8-2-5-9-4-12-10-5/h4,7H,2-3H2,1H3,(H,8,11).
What are the key properties of 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide has a molecular weight of 170.17 g/mol, XLogP of -1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is sourced from PubChem (CID 106396962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).