3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

C10H14N6 — CID 139295708

IUPAC3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESNc1nccn2c(C3CCCCN3)nnc12
InChIInChI=1S/C10H14N6/c11-8-10-15-14-9(16(10)6-5-13-8)7-3-1-2-4-12-7/h5-7,12H,1-4H2,(H2,11,13)
InChIKeyVYJAIEACFNZGGP-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.52
Rot. Bonds1

About 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (PubChem CID 139295708) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
PubChem CID139295708
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESNc1nccn2c(C3CCCCN3)nnc12
InChIInChI=1S/C10H14N6/c11-8-10-15-14-9(16(10)6-5-13-8)7-3-1-2-4-12-7/h5-7,12H,1-4H2,(H2,11,13)
InChIKeyVYJAIEACFNZGGP-UHFFFAOYSA-N
XLogP0.52
TPSA81.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The IUPAC name of 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (CID 139295708) is 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.
What is the SMILES notation for 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The canonical SMILES for 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is Nc1nccn2c(C3CCCCN3)nnc12.
What is the InChIKey of 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The InChIKey is VYJAIEACFNZGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c11-8-10-15-14-9(16(10)6-5-13-8)7-3-1-2-4-12-7/h5-7,12H,1-4H2,(H2,11,13).
What are the key properties of 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine has a molecular weight of 218.26 g/mol, XLogP of 0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is sourced from PubChem (CID 139295708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).