[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine

C6H9F3N2 — CID 82017955

IUPAC[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine
SMILESNNC12CC(C(F)(F)F)(C1)C2
InChIInChI=1S/C6H9F3N2/c7-6(8,9)4-1-5(2-4,3-4)11-10/h11H,1-3,10H2
InChIKeyUOZVVLOLDLAKNL-UHFFFAOYSA-N
MW166.15 g/mol
LogP0.93
Rot. Bonds1

About [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine

[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine (PubChem CID 82017955) has the molecular formula C6H9F3N2 and a molecular weight of 166.15 g/mol. Its IUPAC name is [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine.

Molecular Properties

Compound Name[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine
PubChem CID82017955
Molecular FormulaC6H9F3N2
Molecular Weight166.15 g/mol
Exact Mass166.07
IUPAC Name[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine
SMILESNNC12CC(C(F)(F)F)(C1)C2
InChIInChI=1S/C6H9F3N2/c7-6(8,9)4-1-5(2-4,3-4)11-10/h11H,1-3,10H2
InChIKeyUOZVVLOLDLAKNL-UHFFFAOYSA-N
XLogP0.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine?
The IUPAC name of [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine (CID 82017955) is [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine.
What is the SMILES notation for [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine?
The canonical SMILES for [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine is NNC12CC(C(F)(F)F)(C1)C2.
What is the InChIKey of [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine?
The InChIKey is UOZVVLOLDLAKNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3N2/c7-6(8,9)4-1-5(2-4,3-4)11-10/h11H,1-3,10H2.
What are the key properties of [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine?
[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine has a molecular weight of 166.15 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]hydrazine is sourced from PubChem (CID 82017955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).