5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine

C8H7N7 — CID 103117501

IUPAC5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine
SMILESNc1n[nH]c(-c2cnn3ccncc23)n1
InChIInChI=1S/C8H7N7/c9-8-12-7(13-14-8)5-3-11-15-2-1-10-4-6(5)15/h1-4H,(H3,9,12,13,14)
InChIKeyWIYVOCVMKVDUBY-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.10
Rot. Bonds1

About 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine

5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine (PubChem CID 103117501) has the molecular formula C8H7N7 and a molecular weight of 201.19 g/mol. Its IUPAC name is 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine
PubChem CID103117501
Molecular FormulaC8H7N7
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine
SMILESNc1n[nH]c(-c2cnn3ccncc23)n1
InChIInChI=1S/C8H7N7/c9-8-12-7(13-14-8)5-3-11-15-2-1-10-4-6(5)15/h1-4H,(H3,9,12,13,14)
InChIKeyWIYVOCVMKVDUBY-UHFFFAOYSA-N
XLogP0.10
TPSA97.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine?
The IUPAC name of 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine (CID 103117501) is 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine.
What is the SMILES notation for 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine?
The canonical SMILES for 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine is Nc1n[nH]c(-c2cnn3ccncc23)n1.
What is the InChIKey of 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine?
The InChIKey is WIYVOCVMKVDUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N7/c9-8-12-7(13-14-8)5-3-11-15-2-1-10-4-6(5)15/h1-4H,(H3,9,12,13,14).
What are the key properties of 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine?
5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine has a molecular weight of 201.19 g/mol, XLogP of 0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrazolo[1,5-a]pyrazin-3-yl-1H-1,2,4-triazol-3-amine is sourced from PubChem (CID 103117501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).