5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine

C5H6N4 — CID 69175264

IUPAC5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine
SMILESC1=NCCn2cnnc21
InChIInChI=1S/C5H6N4/c1-2-9-4-7-8-5(9)3-6-1/h3-4H,1-2H2
InChIKeyOUSVTWOQVSAYJW-UHFFFAOYSA-N
MW122.13 g/mol
LogP-0.29
Rot. Bonds

About 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine

5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 69175264) has the molecular formula C5H6N4 and a molecular weight of 122.13 g/mol. Its IUPAC name is 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID69175264
Molecular FormulaC5H6N4
Molecular Weight122.13 g/mol
Exact Mass122.06
IUPAC Name5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine
SMILESC1=NCCn2cnnc21
InChIInChI=1S/C5H6N4/c1-2-9-4-7-8-5(9)3-6-1/h3-4H,1-2H2
InChIKeyOUSVTWOQVSAYJW-UHFFFAOYSA-N
XLogP-0.29
TPSA43.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.13
LogP ≤ 5-0.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine (CID 69175264) is 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine is C1=NCCn2cnnc21.
What is the InChIKey of 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is OUSVTWOQVSAYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4/c1-2-9-4-7-8-5(9)3-6-1/h3-4H,1-2H2.
What are the key properties of 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine?
5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 122.13 g/mol, XLogP of -0.29, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 69175264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).