2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine

C8H9N3O — CID 20635695

IUPAC2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
SMILESCOCc1cc2ncccn2n1
InChIInChI=1S/C8H9N3O/c1-12-6-7-5-8-9-3-2-4-11(8)10-7/h2-5H,6H2,1H3
InChIKeyZHWQGHCHUZELND-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.88
Rot. Bonds2

About 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine

2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 20635695) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID20635695
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
SMILESCOCc1cc2ncccn2n1
InChIInChI=1S/C8H9N3O/c1-12-6-7-5-8-9-3-2-4-11(8)10-7/h2-5H,6H2,1H3
InChIKeyZHWQGHCHUZELND-UHFFFAOYSA-N
XLogP0.88
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine (CID 20635695) is 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine is COCc1cc2ncccn2n1.
What is the InChIKey of 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is ZHWQGHCHUZELND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-12-6-7-5-8-9-3-2-4-11(8)10-7/h2-5H,6H2,1H3.
What are the key properties of 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine?
2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 163.18 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 20635695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).