6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine

C7H10F3N5 — CID 80914178

IUPAC6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESNNc1cncc(NCCC(F)(F)F)n1
InChIInChI=1S/C7H10F3N5/c8-7(9,10)1-2-13-5-3-12-4-6(14-5)15-11/h3-4H,1-2,11H2,(H2,13,14,15)
InChIKeyLLMMTKRVJHKPLC-UHFFFAOYSA-N
MW221.19 g/mol
LogP1.13
Rot. Bonds4

About 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine

6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine (PubChem CID 80914178) has the molecular formula C7H10F3N5 and a molecular weight of 221.19 g/mol. Its IUPAC name is 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
PubChem CID80914178
Molecular FormulaC7H10F3N5
Molecular Weight221.19 g/mol
Exact Mass221.09
IUPAC Name6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine
SMILESNNc1cncc(NCCC(F)(F)F)n1
InChIInChI=1S/C7H10F3N5/c8-7(9,10)1-2-13-5-3-12-4-6(14-5)15-11/h3-4H,1-2,11H2,(H2,13,14,15)
InChIKeyLLMMTKRVJHKPLC-UHFFFAOYSA-N
XLogP1.13
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 51.13
H-Bond Donors ≤ 53
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-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The IUPAC name of 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine (CID 80914178) is 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine is NNc1cncc(NCCC(F)(F)F)n1.
What is the InChIKey of 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
The InChIKey is LLMMTKRVJHKPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3N5/c8-7(9,10)1-2-13-5-3-12-4-6(14-5)15-11/h3-4H,1-2,11H2,(H2,13,14,15).
What are the key properties of 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine?
6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine has a molecular weight of 221.19 g/mol, XLogP of 1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(3,3,3-trifluoropropyl)pyrazin-2-amine is sourced from PubChem (CID 80914178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).