[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine

C6H7F3N4O — CID 80910357

IUPAC[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine
SMILESNNc1cncc(OCC(F)(F)F)n1
InChIInChI=1S/C6H7F3N4O/c7-6(8,9)3-14-5-2-11-1-4(12-5)13-10/h1-2H,3,10H2,(H,12,13)
InChIKeyTYGDTUVQKFCCOY-UHFFFAOYSA-N
MW208.14 g/mol
LogP0.70
Rot. Bonds3

About [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine

[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine (PubChem CID 80910357) has the molecular formula C6H7F3N4O and a molecular weight of 208.14 g/mol. Its IUPAC name is [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine
PubChem CID80910357
Molecular FormulaC6H7F3N4O
Molecular Weight208.14 g/mol
Exact Mass208.06
IUPAC Name[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine
SMILESNNc1cncc(OCC(F)(F)F)n1
InChIInChI=1S/C6H7F3N4O/c7-6(8,9)3-14-5-2-11-1-4(12-5)13-10/h1-2H,3,10H2,(H,12,13)
InChIKeyTYGDTUVQKFCCOY-UHFFFAOYSA-N
XLogP0.70
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.14
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine?
The IUPAC name of [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine (CID 80910357) is [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine?
The canonical SMILES for [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine is NNc1cncc(OCC(F)(F)F)n1.
What is the InChIKey of [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine?
The InChIKey is TYGDTUVQKFCCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3N4O/c7-6(8,9)3-14-5-2-11-1-4(12-5)13-10/h1-2H,3,10H2,(H,12,13).
What are the key properties of [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine?
[6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine has a molecular weight of 208.14 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,2,2-trifluoroethoxy)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 80910357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).