6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine

C10H14N6O — CID 113243843

IUPAC6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCc2noc(C)n2)n1
InChIInChI=1S/C10H14N6O/c1-3-12-8-4-11-5-9(15-8)13-6-10-14-7(2)17-16-10/h4-5H,3,6H2,1-2H3,(H2,12,13,15)
InChIKeyAGWKZOHIJVQABJ-UHFFFAOYSA-N
MW234.26 g/mol
LogP1.21
Rot. Bonds5

About 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine

6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine (PubChem CID 113243843) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine
PubChem CID113243843
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCc2noc(C)n2)n1
InChIInChI=1S/C10H14N6O/c1-3-12-8-4-11-5-9(15-8)13-6-10-14-7(2)17-16-10/h4-5H,3,6H2,1-2H3,(H2,12,13,15)
InChIKeyAGWKZOHIJVQABJ-UHFFFAOYSA-N
XLogP1.21
TPSA88.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine (CID 113243843) is 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine is CCNc1cncc(NCc2noc(C)n2)n1.
What is the InChIKey of 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine?
The InChIKey is AGWKZOHIJVQABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-3-12-8-4-11-5-9(15-8)13-6-10-14-7(2)17-16-10/h4-5H,3,6H2,1-2H3,(H2,12,13,15).
What are the key properties of 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine?
6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine has a molecular weight of 234.26 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyrazine-2,6-diamine is sourced from PubChem (CID 113243843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).