5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine

C12H6Cl2FN3 — CID 82274342

IUPAC5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1-c1cnn2c(Cl)cc(Cl)nc12
InChIInChI=1S/C12H6Cl2FN3/c13-10-5-11(14)18-12(17-10)8(6-16-18)7-3-1-2-4-9(7)15/h1-6H
InChIKeyAJFUKBWWPJBFAU-UHFFFAOYSA-N
MW282.11 g/mol
LogP3.84
Rot. Bonds1

About 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine

5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 82274342) has the molecular formula C12H6Cl2FN3 and a molecular weight of 282.11 g/mol. Its IUPAC name is 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine
PubChem CID82274342
Molecular FormulaC12H6Cl2FN3
Molecular Weight282.11 g/mol
Exact Mass280.99
IUPAC Name5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1-c1cnn2c(Cl)cc(Cl)nc12
InChIInChI=1S/C12H6Cl2FN3/c13-10-5-11(14)18-12(17-10)8(6-16-18)7-3-1-2-4-9(7)15/h1-6H
InChIKeyAJFUKBWWPJBFAU-UHFFFAOYSA-N
XLogP3.84
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.11
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5,7-dichloro-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidine
CID 82274339
7-chloro-3-(2-chlorophenyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 82274740
5,7-dichloro-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 82274347
7-chloro-5-(2-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 21104349
2-chloro-6-fluoro-4-(2-fluorophenyl)quinoline
CID 21488577
5,7-dichloro-6-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514536
5,7-dichloro-3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine
CID 86724872
4-chloro-6-(2-fluorophenyl)-2-methylsulfanylpyrimidine
CID 134110596
6-chloro-3-(2-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 43144392
5-chloro-3-(2-fluorophenyl)-1-methylpyrazole
CID 84678019
N-[3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N',N'-dimethylethane-1,2-diamine
CID 126473476
2-chloro-3-(2-fluorophenyl)pyridine
CID 46312040

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine (CID 82274342) is 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine is Fc1ccccc1-c1cnn2c(Cl)cc(Cl)nc12.
What is the InChIKey of 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is AJFUKBWWPJBFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2FN3/c13-10-5-11(14)18-12(17-10)8(6-16-18)7-3-1-2-4-9(7)15/h1-6H.
What are the key properties of 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine?
5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 282.11 g/mol, XLogP of 3.84, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 82274342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).