5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine

C11H15N5O — CID 66835729

IUPAC5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCOc1cc(N2CCNCC2)n2nccc2n1
InChIInChI=1S/C11H15N5O/c1-17-10-8-11(15-6-4-12-5-7-15)16-9(14-10)2-3-13-16/h2-3,8,12H,4-7H2,1H3
InChIKeyWJEOTOFEQMGWRY-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.15
Rot. Bonds2

About 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine

5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 66835729) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
PubChem CID66835729
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCOc1cc(N2CCNCC2)n2nccc2n1
InChIInChI=1S/C11H15N5O/c1-17-10-8-11(15-6-4-12-5-7-15)16-9(14-10)2-3-13-16/h2-3,8,12H,4-7H2,1H3
InChIKeyWJEOTOFEQMGWRY-UHFFFAOYSA-N
XLogP0.15
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine (CID 66835729) is 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine is COc1cc(N2CCNCC2)n2nccc2n1.
What is the InChIKey of 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is WJEOTOFEQMGWRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-17-10-8-11(15-6-4-12-5-7-15)16-9(14-10)2-3-13-16/h2-3,8,12H,4-7H2,1H3.
What are the key properties of 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine?
5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 233.27 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 66835729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).