2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine

C9H7N5O — CID 68543431

IUPAC2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2nc(-c3ccco3)nc12
InChIInChI=1S/C9H7N5O/c10-7-9-12-8(6-2-1-5-15-6)13-14(9)4-3-11-7/h1-5H,(H2,10,11)
InChIKeyGPHIDWJXKRFWPP-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.97
Rot. Bonds1

About 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine

2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine (PubChem CID 68543431) has the molecular formula C9H7N5O and a molecular weight of 201.19 g/mol. Its IUPAC name is 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
PubChem CID68543431
Molecular FormulaC9H7N5O
Molecular Weight201.19 g/mol
Exact Mass201.07
IUPAC Name2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine
SMILESNc1nccn2nc(-c3ccco3)nc12
InChIInChI=1S/C9H7N5O/c10-7-9-12-8(6-2-1-5-15-6)13-14(9)4-3-11-7/h1-5H,(H2,10,11)
InChIKeyGPHIDWJXKRFWPP-UHFFFAOYSA-N
XLogP0.97
TPSA82.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The IUPAC name of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine (CID 68543431) is 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine is Nc1nccn2nc(-c3ccco3)nc12.
What is the InChIKey of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
The InChIKey is GPHIDWJXKRFWPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5O/c10-7-9-12-8(6-2-1-5-15-6)13-14(9)4-3-11-7/h1-5H,(H2,10,11).
What are the key properties of 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine?
2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine has a molecular weight of 201.19 g/mol, XLogP of 0.97, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 68543431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).