6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

C8H7N7 — CID 175983837

IUPAC6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESNc1nc2cnc(-c3cn[nH]c3)cn2n1
InChIInChI=1S/C8H7N7/c9-8-13-7-3-10-6(4-15(7)14-8)5-1-11-12-2-5/h1-4H,(H2,9,14)(H,11,12)
InChIKeyQTDPPMCFMLZUJE-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.10
Rot. Bonds1

About 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (PubChem CID 175983837) has the molecular formula C8H7N7 and a molecular weight of 201.19 g/mol. Its IUPAC name is 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.

Molecular Properties

Compound Name6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
PubChem CID175983837
Molecular FormulaC8H7N7
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESNc1nc2cnc(-c3cn[nH]c3)cn2n1
InChIInChI=1S/C8H7N7/c9-8-13-7-3-10-6(4-15(7)14-8)5-1-11-12-2-5/h1-4H,(H2,9,14)(H,11,12)
InChIKeyQTDPPMCFMLZUJE-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 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The IUPAC name of 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (CID 175983837) is 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.
What is the SMILES notation for 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The canonical SMILES for 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is Nc1nc2cnc(-c3cn[nH]c3)cn2n1.
What is the InChIKey of 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The InChIKey is QTDPPMCFMLZUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N7/c9-8-13-7-3-10-6(4-15(7)14-8)5-1-11-12-2-5/h1-4H,(H2,9,14)(H,11,12).
What are the key properties of 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-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 6-(1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is sourced from PubChem (CID 175983837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).