2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine

C7H9N5 — CID 43479055

IUPAC2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine
SMILESNCCc1nnc2cnccn12
InChIInChI=1S/C7H9N5/c8-2-1-6-10-11-7-5-9-3-4-12(6)7/h3-5H,1-2,8H2
InChIKeyRZGYNKHYLXTNLZ-UHFFFAOYSA-N
MW163.18 g/mol
LogP-0.37
Rot. Bonds2

About 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine

2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine (PubChem CID 43479055) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine.

Molecular Properties

Compound Name2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine
PubChem CID43479055
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine
SMILESNCCc1nnc2cnccn12
InChIInChI=1S/C7H9N5/c8-2-1-6-10-11-7-5-9-3-4-12(6)7/h3-5H,1-2,8H2
InChIKeyRZGYNKHYLXTNLZ-UHFFFAOYSA-N
XLogP-0.37
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine?
The IUPAC name of 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine (CID 43479055) is 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine.
What is the SMILES notation for 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine?
The canonical SMILES for 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine is NCCc1nnc2cnccn12.
What is the InChIKey of 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine?
The InChIKey is RZGYNKHYLXTNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c8-2-1-6-10-11-7-5-9-3-4-12(6)7/h3-5H,1-2,8H2.
What are the key properties of 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine?
2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine has a molecular weight of 163.18 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)ethanamine is sourced from PubChem (CID 43479055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).