6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine

C7H5F3N4 — CID 84721400

IUPAC6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine
SMILESNc1cnn2cc(C(F)(F)F)cnc12
InChIInChI=1S/C7H5F3N4/c8-7(9,10)4-1-12-6-5(11)2-13-14(6)3-4/h1-3H,11H2
InChIKeyYDYMBPPTKQVKCI-UHFFFAOYSA-N
MW202.14 g/mol
LogP1.33
Rot. Bonds

About 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine

6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine (PubChem CID 84721400) has the molecular formula C7H5F3N4 and a molecular weight of 202.14 g/mol. Its IUPAC name is 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine.

Molecular Properties

Compound Name6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine
PubChem CID84721400
Molecular FormulaC7H5F3N4
Molecular Weight202.14 g/mol
Exact Mass202.05
IUPAC Name6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine
SMILESNc1cnn2cc(C(F)(F)F)cnc12
InChIInChI=1S/C7H5F3N4/c8-7(9,10)4-1-12-6-5(11)2-13-14(6)3-4/h1-3H,11H2
InChIKeyYDYMBPPTKQVKCI-UHFFFAOYSA-N
XLogP1.33
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.14
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-methyl-2-N-(1-methylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69093313
N4-methyl-N2-(1-methyl-2,3-dihydro-1H-imidazo[1,2-b]pyrazol-7-yl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 72201491
Pyrazolo(1,5-a)pyrimidin-6-amine
CID 25247836
Pyrazolo[1,5-a]pyrimidin-3-amine
CID 21192071
5-N,5-N-dimethylpyrazolo[1,5-a]pyrimidine-3,5-diamine
CID 58611206
N,N-dimethylpyrazolo[1,5-a]pyrimidin-3-amine
CID 91447993
5-Pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidin-3-amine
CID 129230006
3-N,3-N,5-N,5-N-tetramethylpyrazolo[1,5-a]pyrimidine-3,5-diamine
CID 176142004
Pyrazolo(1,5-a)pyrimidin-3-amine hydrochloride
CID 21192070
6-Methylpyrazolo(1,5-a)pyrimidin-3-amine
CID 60136465
{Pyrazolo[1,5-a]pyrimidin-6-yl}methanamine
CID 63820624
1-(pyrimidin-5-yl)-1H-pyrazol-3-amine
CID 65690504

Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine?
The IUPAC name of 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine (CID 84721400) is 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine.
What is the SMILES notation for 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine?
The canonical SMILES for 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine is Nc1cnn2cc(C(F)(F)F)cnc12.
What is the InChIKey of 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine?
The InChIKey is YDYMBPPTKQVKCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N4/c8-7(9,10)4-1-12-6-5(11)2-13-14(6)3-4/h1-3H,11H2.
What are the key properties of 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine?
6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine has a molecular weight of 202.14 g/mol, XLogP of 1.33, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-amine is sourced from PubChem (CID 84721400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).