6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine

C9H11N3 — CID 12773561

IUPAC6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine
SMILESCCc1cnc2cc(C)nn2c1
InChIInChI=1S/C9H11N3/c1-3-8-5-10-9-4-7(2)11-12(9)6-8/h4-6H,3H2,1-2H3
InChIKeyONCPTFKSOMMJNR-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.60
Rot. Bonds1

About 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine

6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine (PubChem CID 12773561) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine
PubChem CID12773561
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine
SMILESCCc1cnc2cc(C)nn2c1
InChIInChI=1S/C9H11N3/c1-3-8-5-10-9-4-7(2)11-12(9)6-8/h4-6H,3H2,1-2H3
InChIKeyONCPTFKSOMMJNR-UHFFFAOYSA-N
XLogP1.60
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine (CID 12773561) is 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine is CCc1cnc2cc(C)nn2c1.
What is the InChIKey of 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine?
The InChIKey is ONCPTFKSOMMJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-3-8-5-10-9-4-7(2)11-12(9)6-8/h4-6H,3H2,1-2H3.
What are the key properties of 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine?
6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine has a molecular weight of 161.21 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 12773561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).