5-ethenylpyrazolo[1,5-a]pyrimidine

C8H7N3 — CID 70224896

IUPAC5-ethenylpyrazolo[1,5-a]pyrimidine
SMILESC=Cc1ccn2nccc2n1
InChIInChI=1S/C8H7N3/c1-2-7-4-6-11-8(10-7)3-5-9-11/h2-6H,1H2
InChIKeyCOAAQDIIEGQUBF-UHFFFAOYSA-N
MW145.16 g/mol
LogP1.37
Rot. Bonds1

About 5-ethenylpyrazolo[1,5-a]pyrimidine

5-ethenylpyrazolo[1,5-a]pyrimidine (PubChem CID 70224896) has the molecular formula C8H7N3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 5-ethenylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-ethenylpyrazolo[1,5-a]pyrimidine
PubChem CID70224896
Molecular FormulaC8H7N3
Molecular Weight145.16 g/mol
Exact Mass145.06
IUPAC Name5-ethenylpyrazolo[1,5-a]pyrimidine
SMILESC=Cc1ccn2nccc2n1
InChIInChI=1S/C8H7N3/c1-2-7-4-6-11-8(10-7)3-5-9-11/h2-6H,1H2
InChIKeyCOAAQDIIEGQUBF-UHFFFAOYSA-N
XLogP1.37
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethenylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-ethenylpyrazolo[1,5-a]pyrimidine (CID 70224896) is 5-ethenylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-ethenylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-ethenylpyrazolo[1,5-a]pyrimidine is C=Cc1ccn2nccc2n1.
What is the InChIKey of 5-ethenylpyrazolo[1,5-a]pyrimidine?
The InChIKey is COAAQDIIEGQUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3/c1-2-7-4-6-11-8(10-7)3-5-9-11/h2-6H,1H2.
What are the key properties of 5-ethenylpyrazolo[1,5-a]pyrimidine?
5-ethenylpyrazolo[1,5-a]pyrimidine has a molecular weight of 145.16 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 70224896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).