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

C9H9N7 — CID 66583323

IUPAC8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESCn1cc(-c2nccn3nc(N)nc23)cn1
InChIInChI=1S/C9H9N7/c1-15-5-6(4-12-15)7-8-13-9(10)14-16(8)3-2-11-7/h2-5H,1H3,(H2,10,14)
InChIKeyYAOGHGMWVMIZLU-UHFFFAOYSA-N
MW215.22 g/mol
LogP0.11
Rot. Bonds1

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

8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (PubChem CID 66583323) has the molecular formula C9H9N7 and a molecular weight of 215.22 g/mol. Its IUPAC name is 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.

Molecular Properties

Compound Name8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
PubChem CID66583323
Molecular FormulaC9H9N7
Molecular Weight215.22 g/mol
Exact Mass215.09
IUPAC Name8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESCn1cc(-c2nccn3nc(N)nc23)cn1
InChIInChI=1S/C9H9N7/c1-15-5-6(4-12-15)7-8-13-9(10)14-16(8)3-2-11-7/h2-5H,1H3,(H2,10,14)
InChIKeyYAOGHGMWVMIZLU-UHFFFAOYSA-N
XLogP0.11
TPSA86.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The IUPAC name of 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (CID 66583323) is 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.
What is the SMILES notation for 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The canonical SMILES for 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is Cn1cc(-c2nccn3nc(N)nc23)cn1.
What is the InChIKey of 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The InChIKey is YAOGHGMWVMIZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N7/c1-15-5-6(4-12-15)7-8-13-9(10)14-16(8)3-2-11-7/h2-5H,1H3,(H2,10,14).
What are the key properties of 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine has a molecular weight of 215.22 g/mol, XLogP of 0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is sourced from PubChem (CID 66583323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).