N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine

C9H8F4N4 — CID 106293786

IUPACN-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)C(F)(F)CNc1nccn2nccc12
InChIInChI=1S/C9H8F4N4/c10-8(11)9(12,13)5-15-7-6-1-2-16-17(6)4-3-14-7/h1-4,8H,5H2,(H,14,15)
InChIKeyKUFPMQOTBNIPQR-UHFFFAOYSA-N
MW248.18 g/mol
LogP2.04
Rot. Bonds4

About N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine

N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 106293786) has the molecular formula C9H8F4N4 and a molecular weight of 248.18 g/mol. Its IUPAC name is N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID106293786
Molecular FormulaC9H8F4N4
Molecular Weight248.18 g/mol
Exact Mass248.07
IUPAC NameN-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine
SMILESFC(F)C(F)(F)CNc1nccn2nccc12
InChIInChI=1S/C9H8F4N4/c10-8(11)9(12,13)5-15-7-6-1-2-16-17(6)4-3-14-7/h1-4,8H,5H2,(H,14,15)
InChIKeyKUFPMQOTBNIPQR-UHFFFAOYSA-N
XLogP2.04
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.18
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine (CID 106293786) is N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine is FC(F)C(F)(F)CNc1nccn2nccc12.
What is the InChIKey of N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is KUFPMQOTBNIPQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F4N4/c10-8(11)9(12,13)5-15-7-6-1-2-16-17(6)4-3-14-7/h1-4,8H,5H2,(H,14,15).
What are the key properties of N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine?
N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 248.18 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3,3-tetrafluoropropyl)pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 106293786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).