5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

C5H8N4 — CID 18406919

IUPAC5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESc1nc2n(n1)CCNC2
InChIInChI=1S/C5H8N4/c1-2-9-5(3-6-1)7-4-8-9/h4,6H,1-3H2
InChIKeyDXJKRLHHCGXHMB-UHFFFAOYSA-N
MW124.15 g/mol
LogP-0.62
Rot. Bonds

About 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 18406919) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID18406919
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC Name5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESc1nc2n(n1)CCNC2
InChIInChI=1S/C5H8N4/c1-2-9-5(3-6-1)7-4-8-9/h4,6H,1-3H2
InChIKeyDXJKRLHHCGXHMB-UHFFFAOYSA-N
XLogP-0.62
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (CID 18406919) is 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is c1nc2n(n1)CCNC2.
What is the InChIKey of 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is DXJKRLHHCGXHMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4/c1-2-9-5(3-6-1)7-4-8-9/h4,6H,1-3H2.
What are the key properties of 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 124.15 g/mol, XLogP of -0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 18406919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).