2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one

C15H15N3O — CID 91886931

IUPAC2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one
SMILESCCCn1ccn2nc(-c3ccccc3)cc2c1=O
InChIInChI=1S/C15H15N3O/c1-2-8-17-9-10-18-14(15(17)19)11-13(16-18)12-6-4-3-5-7-12/h3-7,9-11H,2,8H2,1H3
InChIKeyOSFMFEUTFNEOOJ-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.57
Rot. Bonds3

About 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one

2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one (PubChem CID 91886931) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one
PubChem CID91886931
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one
SMILESCCCn1ccn2nc(-c3ccccc3)cc2c1=O
InChIInChI=1S/C15H15N3O/c1-2-8-17-9-10-18-14(15(17)19)11-13(16-18)12-6-4-3-5-7-12/h3-7,9-11H,2,8H2,1H3
InChIKeyOSFMFEUTFNEOOJ-UHFFFAOYSA-N
XLogP2.57
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one (CID 91886931) is 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one is CCCn1ccn2nc(-c3ccccc3)cc2c1=O.
What is the InChIKey of 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is OSFMFEUTFNEOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-2-8-17-9-10-18-14(15(17)19)11-13(16-18)12-6-4-3-5-7-12/h3-7,9-11H,2,8H2,1H3.
What are the key properties of 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one?
2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 253.31 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-propylpyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 91886931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).