4,7-dihydropyrazolo[1,5-a]pyrimidine

C6H7N3 — CID 135745164

IUPAC4,7-dihydropyrazolo[1,5-a]pyrimidine
SMILESC1=CNc2ccnn2C1
InChIInChI=1S/C6H7N3/c1-3-7-6-2-4-8-9(6)5-1/h1-4,7H,5H2
InChIKeyLSCPRSARMGLOSF-UHFFFAOYSA-N
MW121.14 g/mol
LogP0.82
Rot. Bonds

About 4,7-dihydropyrazolo[1,5-a]pyrimidine

4,7-dihydropyrazolo[1,5-a]pyrimidine (PubChem CID 135745164) has the molecular formula C6H7N3 and a molecular weight of 121.14 g/mol. Its IUPAC name is 4,7-dihydropyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name4,7-dihydropyrazolo[1,5-a]pyrimidine
PubChem CID135745164
Molecular FormulaC6H7N3
Molecular Weight121.14 g/mol
Exact Mass121.06
IUPAC Name4,7-dihydropyrazolo[1,5-a]pyrimidine
SMILESC1=CNc2ccnn2C1
InChIInChI=1S/C6H7N3/c1-3-7-6-2-4-8-9(6)5-1/h1-4,7H,5H2
InChIKeyLSCPRSARMGLOSF-UHFFFAOYSA-N
XLogP0.82
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.14
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,7-dihydropyrazolo[1,5-a]pyrimidine?
The IUPAC name of 4,7-dihydropyrazolo[1,5-a]pyrimidine (CID 135745164) is 4,7-dihydropyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 4,7-dihydropyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 4,7-dihydropyrazolo[1,5-a]pyrimidine is C1=CNc2ccnn2C1.
What is the InChIKey of 4,7-dihydropyrazolo[1,5-a]pyrimidine?
The InChIKey is LSCPRSARMGLOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3/c1-3-7-6-2-4-8-9(6)5-1/h1-4,7H,5H2.
What are the key properties of 4,7-dihydropyrazolo[1,5-a]pyrimidine?
4,7-dihydropyrazolo[1,5-a]pyrimidine has a molecular weight of 121.14 g/mol, XLogP of 0.82, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dihydropyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 135745164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).