5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one

C12H17N5O — CID 113446751

IUPAC5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1c2ccnn2ccn1CCN1CCNCC1
InChIInChI=1S/C12H17N5O/c18-12-11-1-2-14-17(11)10-9-16(12)8-7-15-5-3-13-4-6-15/h1-2,9-10,13H,3-8H2
InChIKeyDPMQWSIXTBUUDK-UHFFFAOYSA-N
MW247.30 g/mol
LogP-0.60
Rot. Bonds3

About 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one

5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 113446751) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
PubChem CID113446751
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1c2ccnn2ccn1CCN1CCNCC1
InChIInChI=1S/C12H17N5O/c18-12-11-1-2-14-17(11)10-9-16(12)8-7-15-5-3-13-4-6-15/h1-2,9-10,13H,3-8H2
InChIKeyDPMQWSIXTBUUDK-UHFFFAOYSA-N
XLogP-0.60
TPSA54.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one (CID 113446751) is 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one is O=c1c2ccnn2ccn1CCN1CCNCC1.
What is the InChIKey of 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is DPMQWSIXTBUUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c18-12-11-1-2-14-17(11)10-9-16(12)8-7-15-5-3-13-4-6-15/h1-2,9-10,13H,3-8H2.
What are the key properties of 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one?
5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 247.30 g/mol, XLogP of -0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 113446751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).