[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine

C12H22F3N3 — CID 105265683

IUPAC[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine
SMILESCN1C2CCC1CC(C(CCC(F)(F)F)NN)C2
InChIInChI=1S/C12H22F3N3/c1-18-9-2-3-10(18)7-8(6-9)11(17-16)4-5-12(13,14)15/h8-11,17H,2-7,16H2,1H3
InChIKeyHAZAEJRSDJPVJX-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.03
Rot. Bonds4

About [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine

[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine (PubChem CID 105265683) has the molecular formula C12H22F3N3 and a molecular weight of 265.32 g/mol. Its IUPAC name is [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine.

Molecular Properties

Compound Name[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine
PubChem CID105265683
Molecular FormulaC12H22F3N3
Molecular Weight265.32 g/mol
Exact Mass265.18
IUPAC Name[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine
SMILESCN1C2CCC1CC(C(CCC(F)(F)F)NN)C2
InChIInChI=1S/C12H22F3N3/c1-18-9-2-3-10(18)7-8(6-9)11(17-16)4-5-12(13,14)15/h8-11,17H,2-7,16H2,1H3
InChIKeyHAZAEJRSDJPVJX-UHFFFAOYSA-N
XLogP2.03
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine?
The IUPAC name of [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine (CID 105265683) is [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine.
What is the SMILES notation for [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine?
The canonical SMILES for [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine is CN1C2CCC1CC(C(CCC(F)(F)F)NN)C2.
What is the InChIKey of [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine?
The InChIKey is HAZAEJRSDJPVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22F3N3/c1-18-9-2-3-10(18)7-8(6-9)11(17-16)4-5-12(13,14)15/h8-11,17H,2-7,16H2,1H3.
What are the key properties of [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine?
[4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine has a molecular weight of 265.32 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4,4-trifluoro-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine is sourced from PubChem (CID 105265683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).