5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C19H15N3O2 — CID 830266

IUPAC5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1ccc(-c2cc(=O)n3[nH]c(-c4ccccc4)cc3n2)cc1
InChIInChI=1S/C19H15N3O2/c1-24-15-9-7-14(8-10-15)16-12-19(23)22-18(20-16)11-17(21-22)13-5-3-2-4-6-13/h2-12,21H,1H3
InChIKeyUMJGKCGOJGPXFU-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.37
Rot. Bonds3

About 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 830266) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID830266
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC Name5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1ccc(-c2cc(=O)n3[nH]c(-c4ccccc4)cc3n2)cc1
InChIInChI=1S/C19H15N3O2/c1-24-15-9-7-14(8-10-15)16-12-19(23)22-18(20-16)11-17(21-22)13-5-3-2-4-6-13/h2-12,21H,1H3
InChIKeyUMJGKCGOJGPXFU-UHFFFAOYSA-N
XLogP3.37
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-3-(4-methoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 971409
2-(3-Methoxyphenyl)-5-phenylpyrazolo[1,5-A]pyrimidin-7-OL
CID 2818874
4-Hydroxy-6-(4-methoxyphenyl)-2-phenyl-5-pyrimidinecarbonitrile
CID 135501757
2-(4-methoxybenzyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 879313
2-[(E)-2-(4-methoxyphenyl)ethenyl]-6-phenyl-1H-pyrimidin-4-one
CID 135437680
2-(4-methoxyphenyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 10848404
6-benzyl-2-(4-methoxyphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 667143
2-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-ol
CID 807711
Ethyl [7-hydroxy-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]acetate
CID 1084421
2-(phenoxymethyl)-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 1266350
6-chloro-2-(4-methoxybenzyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7(4H)-one
CID 1370213
2-(4-Methoxyphenyl)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
CID 1851458

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 830266) is 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is COc1ccc(-c2cc(=O)n3[nH]c(-c4ccccc4)cc3n2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is UMJGKCGOJGPXFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2/c1-24-15-9-7-14(8-10-15)16-12-19(23)22-18(20-16)11-17(21-22)13-5-3-2-4-6-13/h2-12,21H,1H3.
What are the key properties of 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 317.35 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 830266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).