5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one

C13H13N5O2 — CID 104734481

IUPAC5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESNc1ccc(=O)n(CCn2ccn3nccc3c2=O)c1
InChIInChI=1S/C13H13N5O2/c14-10-1-2-12(19)17(9-10)6-5-16-7-8-18-11(13(16)20)3-4-15-18/h1-4,7-9H,5-6,14H2
InChIKeyPOKKLHWAOKAJAJ-UHFFFAOYSA-N
MW271.28 g/mol
LogP-0.06
Rot. Bonds3

About 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one

5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 104734481) has the molecular formula C13H13N5O2 and a molecular weight of 271.28 g/mol. Its IUPAC name is 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one
PubChem CID104734481
Molecular FormulaC13H13N5O2
Molecular Weight271.28 g/mol
Exact Mass271.11
IUPAC Name5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESNc1ccc(=O)n(CCn2ccn3nccc3c2=O)c1
InChIInChI=1S/C13H13N5O2/c14-10-1-2-12(19)17(9-10)6-5-16-7-8-18-11(13(16)20)3-4-15-18/h1-4,7-9H,5-6,14H2
InChIKeyPOKKLHWAOKAJAJ-UHFFFAOYSA-N
XLogP-0.06
TPSA87.32 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(2-piperazin-1-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
CID 113446751
5-butylpyrazolo[1,5-a]pyrazin-4-one
CID 154883945
5-[2-(propylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734768
5-[2-(3-aminophenoxy)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734464
5-(3-hydroxybutyl)pyrazolo[1,5-a]pyrazin-4-one
CID 104735134
5-(5-aminohexyl)pyrazolo[1,5-a]pyrazin-4-one
CID 113446718
5-(2-piperidin-2-ylethyl)pyrazolo[1,5-a]pyrazin-4-one
CID 104734984
5-[2-(2-methoxyethylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735369
5-[2-(2-chloroanilino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735392
5-[2-(2-thiophen-3-ylethylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735362
5-[2-(2-ethoxyethylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735396
5-[(2-amino-6-fluorophenyl)methyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734485

Frequently Asked Questions

What is the IUPAC name of 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one (CID 104734481) is 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one is Nc1ccc(=O)n(CCn2ccn3nccc3c2=O)c1.
What is the InChIKey of 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is POKKLHWAOKAJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O2/c14-10-1-2-12(19)17(9-10)6-5-16-7-8-18-11(13(16)20)3-4-15-18/h1-4,7-9H,5-6,14H2.
What are the key properties of 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one?
5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 271.28 g/mol, XLogP of -0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(5-amino-2-oxo-1-pyridinyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 104734481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).