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

C8H12N4O2 — CID 106396856

IUPAC2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESO=C(CNC1CC1)NCc1ncon1
InChIInChI=1S/C8H12N4O2/c13-8(4-9-6-1-2-6)10-3-7-11-5-14-12-7/h5-6,9H,1-4H2,(H,10,13)
InChIKeyXEDWESVISMIQQU-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.56
Rot. Bonds5

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

2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (PubChem CID 106396856) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
PubChem CID106396856
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC Name2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
SMILESO=C(CNC1CC1)NCc1ncon1
InChIInChI=1S/C8H12N4O2/c13-8(4-9-6-1-2-6)10-3-7-11-5-14-12-7/h5-6,9H,1-4H2,(H,10,13)
InChIKeyXEDWESVISMIQQU-UHFFFAOYSA-N
XLogP-0.56
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide (CID 106396856) is 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is O=C(CNC1CC1)NCc1ncon1.
What is the InChIKey of 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
The InChIKey is XEDWESVISMIQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c13-8(4-9-6-1-2-6)10-3-7-11-5-14-12-7/h5-6,9H,1-4H2,(H,10,13).
What are the key properties of 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide?
2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide has a molecular weight of 196.21 g/mol, XLogP of -0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide is sourced from PubChem (CID 106396856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).