7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine

C8H14N4 — CID 121313092

IUPAC7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCCCN1CCn2ncnc2C1
InChIInChI=1S/C8H14N4/c1-2-3-11-4-5-12-8(6-11)9-7-10-12/h7H,2-6H2,1H3
InChIKeyCGJVIILCWQXCNZ-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.50
Rot. Bonds2

About 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine

7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 121313092) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID121313092
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCCCN1CCn2ncnc2C1
InChIInChI=1S/C8H14N4/c1-2-3-11-4-5-12-8(6-11)9-7-10-12/h7H,2-6H2,1H3
InChIKeyCGJVIILCWQXCNZ-UHFFFAOYSA-N
XLogP0.50
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine (CID 121313092) is 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine is CCCN1CCn2ncnc2C1.
What is the InChIKey of 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is CGJVIILCWQXCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-2-3-11-4-5-12-8(6-11)9-7-10-12/h7H,2-6H2,1H3.
What are the key properties of 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 166.23 g/mol, XLogP of 0.50, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 121313092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).