N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine

C8H7F3N4 — CID 104730486

IUPACN-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)(F)CNc1nccn2nccc12
InChIInChI=1S/C8H7F3N4/c9-8(10,11)5-13-7-6-1-2-14-15(6)4-3-12-7/h1-4H,5H2,(H,12,13)
InChIKeyXMEXYDZULXEUAP-UHFFFAOYSA-N
MW216.17 g/mol
LogP1.70
Rot. Bonds2

About N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine

N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104730486) has the molecular formula C8H7F3N4 and a molecular weight of 216.17 g/mol. Its IUPAC name is N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104730486
Molecular FormulaC8H7F3N4
Molecular Weight216.17 g/mol
Exact Mass216.06
IUPAC NameN-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)(F)CNc1nccn2nccc12
InChIInChI=1S/C8H7F3N4/c9-8(10,11)5-13-7-6-1-2-14-15(6)4-3-12-7/h1-4H,5H2,(H,12,13)
InChIKeyXMEXYDZULXEUAP-UHFFFAOYSA-N
XLogP1.70
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.17
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine (CID 104730486) is N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine is FC(F)(F)CNc1nccn2nccc12.
What is the InChIKey of N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is XMEXYDZULXEUAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N4/c9-8(10,11)5-13-7-6-1-2-14-15(6)4-3-12-7/h1-4H,5H2,(H,12,13).
What are the key properties of N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine?
N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 216.17 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoroethyl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104730486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).