7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one

C13H11N3O — CID 721644

IUPAC7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one
SMILESCc1cc(-c2ccccc2)nc2cc(=O)[nH]n12
InChIInChI=1S/C13H11N3O/c1-9-7-11(10-5-3-2-4-6-10)14-12-8-13(17)15-16(9)12/h2-8H,1H3,(H,15,17)
InChIKeyYHPLVWUWPHQOAW-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.00
Rot. Bonds1

About 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one

7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one (PubChem CID 721644) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one.

Molecular Properties

Compound Name7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one
PubChem CID721644
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one
SMILESCc1cc(-c2ccccc2)nc2cc(=O)[nH]n12
InChIInChI=1S/C13H11N3O/c1-9-7-11(10-5-3-2-4-6-10)14-12-8-13(17)15-16(9)12/h2-8H,1H3,(H,15,17)
InChIKeyYHPLVWUWPHQOAW-UHFFFAOYSA-N
XLogP2.00
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidin-2(1H)-one
CID 721643
2-benzyl-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 935434
2-(2-Phenylethyl)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
CID 666509
2-Benzyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
CID 935197
3-Bromo-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-ol
CID 3092876
2-[4-[(3-fluorophenyl)methylidene]-3H-pyridin-6-yl]-5-methyl-1H-pyrazol-3-one
CID 69190697
5-methyl-2-phenethyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 935435
5,7-Dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-2-ol
CID 702848
6-Methyl-4-(4-methylphenyl)-aminopyrimidin-2(1h)-one
CID 13165300
7-phenyl-5-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-one
CID 13359135
5-phenyl-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-one
CID 13379045
1-Phenylethanone (4-hydroxy-6-methyl-2-pyrimidinyl)hydrazone
CID 135421725

Frequently Asked Questions

What is the IUPAC name of 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one?
The IUPAC name of 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one (CID 721644) is 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one.
What is the SMILES notation for 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one?
The canonical SMILES for 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one is Cc1cc(-c2ccccc2)nc2cc(=O)[nH]n12.
What is the InChIKey of 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one?
The InChIKey is YHPLVWUWPHQOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-9-7-11(10-5-3-2-4-6-10)14-12-8-13(17)15-16(9)12/h2-8H,1H3,(H,15,17).
What are the key properties of 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one?
7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one has a molecular weight of 225.25 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one is sourced from PubChem (CID 721644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).