5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

C19H14FN3O2 — CID 171140464

IUPAC5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1cccc(-c2c[nH]n3c(=O)cc(-c4ccccc4F)nc23)c1
InChIInChI=1S/C19H14FN3O2/c1-25-13-6-4-5-12(9-13)15-11-21-23-18(24)10-17(22-19(15)23)14-7-2-3-8-16(14)20/h2-11,21H,1H3
InChIKeyUBWUOSPJLSIXDG-UHFFFAOYSA-N
MW335.34 g/mol
LogP3.50
Rot. Bonds3

About 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 171140464) has the molecular formula C19H14FN3O2 and a molecular weight of 335.34 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID171140464
Molecular FormulaC19H14FN3O2
Molecular Weight335.34 g/mol
Exact Mass335.11
IUPAC Name5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOc1cccc(-c2c[nH]n3c(=O)cc(-c4ccccc4F)nc23)c1
InChIInChI=1S/C19H14FN3O2/c1-25-13-6-4-5-12(9-13)15-11-21-23-18(24)10-17(22-19(15)23)14-7-2-3-8-16(14)20/h2-11,21H,1H3
InChIKeyUBWUOSPJLSIXDG-UHFFFAOYSA-N
XLogP3.50
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-methoxyphenyl)-5-(2-pyridin-3-ylethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172659006
5-cyclohex-3-en-1-yl-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172673795
4-(2-fluorophenyl)-6-(3-methoxyphenyl)pyrimidin-2-amine
CID 75359921
3-(4-fluorophenyl)-5-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 70925446
5-(3-fluorophenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 171140481
5-(3-methoxyphenyl)-2-methyl-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 17079174
2-fluoro-6-(3-methoxyphenyl)phenol
CID 171109408
5-ethyl-3-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 10514153
3-(3,4-dimethoxyphenyl)-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 6484562
3-(3-bromophenyl)-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 675415
5-(6-fluoro-2H-benzotriazol-5-yl)-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 70925759
3-(4-methoxyphenyl)-2-methyl-5-(2-methylphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 17168369

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 171140464) is 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is COc1cccc(-c2c[nH]n3c(=O)cc(-c4ccccc4F)nc23)c1.
What is the InChIKey of 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is UBWUOSPJLSIXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O2/c1-25-13-6-4-5-12(9-13)15-11-21-23-18(24)10-17(22-19(15)23)14-7-2-3-8-16(14)20/h2-11,21H,1H3.
What are the key properties of 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 335.34 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-3-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 171140464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).