pyrazolo[1,5-a]pyrimidine

C6H5N3 — CID 11636795

IUPACpyrazolo[1,5-a]pyrimidine
SMILESc1cnc2ccnn2c1
InChIInChI=1S/C6H5N3/c1-3-7-6-2-4-8-9(6)5-1/h1-5H
InChIKeyLDIJKUBTLZTFRG-UHFFFAOYSA-N
MW119.13 g/mol
LogP0.73
Rot. Bonds

About pyrazolo[1,5-a]pyrimidine

pyrazolo[1,5-a]pyrimidine (PubChem CID 11636795) has the molecular formula C6H5N3 and a molecular weight of 119.13 g/mol. Its IUPAC name is pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Namepyrazolo[1,5-a]pyrimidine
PubChem CID11636795
Molecular FormulaC6H5N3
Molecular Weight119.13 g/mol
Exact Mass119.05
IUPAC Namepyrazolo[1,5-a]pyrimidine
SMILESc1cnc2ccnn2c1
InChIInChI=1S/C6H5N3/c1-3-7-6-2-4-8-9(6)5-1/h1-5H
InChIKeyLDIJKUBTLZTFRG-UHFFFAOYSA-N
XLogP0.73
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.13
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyrazolo[1,5-a]pyrimidine?
The IUPAC name of pyrazolo[1,5-a]pyrimidine (CID 11636795) is pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for pyrazolo[1,5-a]pyrimidine is c1cnc2ccnn2c1.
What is the InChIKey of pyrazolo[1,5-a]pyrimidine?
The InChIKey is LDIJKUBTLZTFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3/c1-3-7-6-2-4-8-9(6)5-1/h1-5H.
What are the key properties of pyrazolo[1,5-a]pyrimidine?
pyrazolo[1,5-a]pyrimidine has a molecular weight of 119.13 g/mol, XLogP of 0.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 11636795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).