1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one

C10H13N5O2 — CID 103907696

IUPAC1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one
SMILESCCn1ccnc(NCCc2ncno2)c1=O
InChIInChI=1S/C10H13N5O2/c1-2-15-6-5-12-9(10(15)16)11-4-3-8-13-7-14-17-8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyQOZZNLFNNPBONM-UHFFFAOYSA-N
MW235.25 g/mol
LogP0.30
Rot. Bonds5

About 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one

1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one (PubChem CID 103907696) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one
PubChem CID103907696
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one
SMILESCCn1ccnc(NCCc2ncno2)c1=O
InChIInChI=1S/C10H13N5O2/c1-2-15-6-5-12-9(10(15)16)11-4-3-8-13-7-14-17-8/h5-7H,2-4H2,1H3,(H,11,12)
InChIKeyQOZZNLFNNPBONM-UHFFFAOYSA-N
XLogP0.30
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one?
The IUPAC name of 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one (CID 103907696) is 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one is CCn1ccnc(NCCc2ncno2)c1=O.
What is the InChIKey of 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one?
The InChIKey is QOZZNLFNNPBONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-2-15-6-5-12-9(10(15)16)11-4-3-8-13-7-14-17-8/h5-7H,2-4H2,1H3,(H,11,12).
What are the key properties of 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one?
1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one has a molecular weight of 235.25 g/mol, XLogP of 0.30, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]pyrazin-2-one is sourced from PubChem (CID 103907696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).