2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine

C7H5F2N3 — CID 91524203

IUPAC2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
SMILESFC(F)c1cc2ncccn2n1
InChIInChI=1S/C7H5F2N3/c8-7(9)5-4-6-10-2-1-3-12(6)11-5/h1-4,7H
InChIKeyZURHDSQLRUNOLR-UHFFFAOYSA-N
MW169.13 g/mol
LogP1.67
Rot. Bonds1

About 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine

2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 91524203) has the molecular formula C7H5F2N3 and a molecular weight of 169.13 g/mol. Its IUPAC name is 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID91524203
Molecular FormulaC7H5F2N3
Molecular Weight169.13 g/mol
Exact Mass169.05
IUPAC Name2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
SMILESFC(F)c1cc2ncccn2n1
InChIInChI=1S/C7H5F2N3/c8-7(9)5-4-6-10-2-1-3-12(6)11-5/h1-4,7H
InChIKeyZURHDSQLRUNOLR-UHFFFAOYSA-N
XLogP1.67
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.13
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Trapidil
CID 5531
Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
Pyrazolo(1.5-a)pyrimidine, 5,7-dimethyl-3-iodo-
CID 206164
Pyrazolo(1,5-a)pyrimidine
CID 11636795
5-Methyl-s-triazolo(1,5-a)pyrimidine
CID 584230
5-Methylpyrazolo[1,5-a]pyrimidine
CID 12581392
2-Methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 1480446
3,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 18684975
5,7-Dimethyl 3-fluoro pyrazolo[1,5-a]pyrimidine
CID 20324958
7-Methylpyrazolo(1,5-a)pyrimidine
CID 12581393
5-Methyl-7-piperidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 12366048
5,7-Bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 13115788

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine (CID 91524203) is 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine is FC(F)c1cc2ncccn2n1.
What is the InChIKey of 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is ZURHDSQLRUNOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2N3/c8-7(9)5-4-6-10-2-1-3-12(6)11-5/h1-4,7H.
What are the key properties of 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 169.13 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 91524203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).