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

C7H5F2N3 — CID 168654914

IUPAC7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
SMILESFC(F)c1ccnc2ccnn12
InChIInChI=1S/C7H5F2N3/c8-7(9)5-1-3-10-6-2-4-11-12(5)6/h1-4,7H
InChIKeyBKOOGSPDURSCTQ-UHFFFAOYSA-N
MW169.13 g/mol
LogP1.67
Rot. Bonds1

About 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine

7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine (PubChem CID 168654914) has the molecular formula C7H5F2N3 and a molecular weight of 169.13 g/mol. Its IUPAC name is 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
PubChem CID168654914
Molecular FormulaC7H5F2N3
Molecular Weight169.13 g/mol
Exact Mass169.05
IUPAC Name7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
SMILESFC(F)c1ccnc2ccnn12
InChIInChI=1S/C7H5F2N3/c8-7(9)5-1-3-10-6-2-4-11-12(5)6/h1-4,7H
InChIKeyBKOOGSPDURSCTQ-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

7-(1-phenylpropan-2-yl)pyrazolo[1,5-a]pyrimidine
CID 123870425
7-(difluoromethyl)-2-ethynylpyrazolo[1,5-a]pyrimidine
CID 141155969
methane;8-propan-2-ylimidazo[1,2-b]pyridazine;bis(7-propan-2-ylpyrazolo[1,5-a]pyrimidine)
CID 158768927
5-(3,4-dichlorophenyl)-7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 4767452
7-(difluoromethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine
CID 141127549
7-(methoxymethyl)pyrazolo[1,5-a]pyrimidine
CID 142675794
N,N-dipropylpyrazolo[1,5-a]pyrimidin-7-amine
CID 70020006
N-(1-phenylethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 110851024
6-pyrazolo[1,5-a]pyrimidin-7-ylnaphthalen-2-ol
CID 166336559
7-(4-methylsulfanylphenyl)pyrazolo[1,5-a]pyrimidine
CID 110205617
(4S)-5-[[2-(difluoromethyl)-6-pyrazolo[1,5-a]pyrimidin-7-yl-3-pyridinyl]oxy]-2,4-dimethylpentan-2-amine
CID 135284477
1-N,4-N-bis(pyrazolo[1,5-a]pyrimidin-7-yl)cyclohexane-1,4-dicarboxamide
CID 56573678

Frequently Asked Questions

What is the IUPAC name of 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine (CID 168654914) is 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine is FC(F)c1ccnc2ccnn12.
What is the InChIKey of 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is BKOOGSPDURSCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2N3/c8-7(9)5-1-3-10-6-2-4-11-12(5)6/h1-4,7H.
What are the key properties of 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine?
7-(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 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 168654914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).