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

C10H9F3N4 — CID 84728227

IUPAC1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine
SMILESNC1(c2cnn3cc(C(F)(F)F)cnc23)CC1
InChIInChI=1S/C10H9F3N4/c11-10(12,13)6-3-15-8-7(9(14)1-2-9)4-16-17(8)5-6/h3-5H,1-2,14H2
InChIKeyYEJQCGKVHQWNKX-UHFFFAOYSA-N
MW242.20 g/mol
LogP1.70
Rot. Bonds1

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

1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine (PubChem CID 84728227) has the molecular formula C10H9F3N4 and a molecular weight of 242.20 g/mol. Its IUPAC name is 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine
PubChem CID84728227
Molecular FormulaC10H9F3N4
Molecular Weight242.20 g/mol
Exact Mass242.08
IUPAC Name1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine
SMILESNC1(c2cnn3cc(C(F)(F)F)cnc23)CC1
InChIInChI=1S/C10H9F3N4/c11-10(12,13)6-3-15-8-7(9(14)1-2-9)4-16-17(8)5-6/h3-5H,1-2,14H2
InChIKeyYEJQCGKVHQWNKX-UHFFFAOYSA-N
XLogP1.70
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-((1,2,4)Triazolo(1,5-a)pyrimidin-6-yl)propan-1-amine dihydrochloride
CID 91623794
8-cyclopentyl-N-methyl-2-(trifluoromethyl)pyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 68940652
2-Piperazin-1-yl-3-(2,3,3-trifluoropropyl)pyrazolo[1,5-a]pyrimidine
CID 89810595
2-Piperazin-1-yl-3-(3,3,3-trifluoropropyl)pyrazolo[1,5-a]pyrimidine
CID 89810597
N,N-dimethyl-6-(5,6,6-trifluorohex-5-enyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 141150483
2-(1-Methylpyrazol-4-yl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]ethanamine
CID 142794012
6-butan-2-yl-5-chloro-3-ethyl-N-(1,1,1-trifluoropropan-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 143059516
3-Tert-butyl-6-fluoropyrazolo[1,5-a]pyrimidin-2-amine
CID 164955557
6-(2-Azaspiro[3.3]heptan-6-ylmethyl)-3-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 170785052
3-(2-Azaspiro[3.3]heptan-6-ylmethyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 171533004
2-Chloro-4-(4-cyclopropylpyrazol-1-yl)-5-fluoropyrimidine
CID 172591551
3-(Piperidin-4-ylmethyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 174285978

Frequently Asked Questions

What is the IUPAC name of 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine?
The IUPAC name of 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine (CID 84728227) is 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine is NC1(c2cnn3cc(C(F)(F)F)cnc23)CC1.
What is the InChIKey of 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine?
The InChIKey is YEJQCGKVHQWNKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4/c11-10(12,13)6-3-15-8-7(9(14)1-2-9)4-16-17(8)5-6/h3-5H,1-2,14H2.
What are the key properties of 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine?
1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine has a molecular weight of 242.20 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]cyclopropan-1-amine is sourced from PubChem (CID 84728227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).