6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine

C9H20F3N3 — CID 105238816

IUPAC6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine
SMILESCN(C)C(C)(C)C(CCC(F)(F)F)NN
InChIInChI=1S/C9H20F3N3/c1-8(2,15(3)4)7(14-13)5-6-9(10,11)12/h7,14H,5-6,13H2,1-4H3
InChIKeyXRKHUFYMWPRSQL-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.50
Rot. Bonds5

About 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine

6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine (PubChem CID 105238816) has the molecular formula C9H20F3N3 and a molecular weight of 227.27 g/mol. Its IUPAC name is 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine.

Molecular Properties

Compound Name6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine
PubChem CID105238816
Molecular FormulaC9H20F3N3
Molecular Weight227.27 g/mol
Exact Mass227.16
IUPAC Name6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine
SMILESCN(C)C(C)(C)C(CCC(F)(F)F)NN
InChIInChI=1S/C9H20F3N3/c1-8(2,15(3)4)7(14-13)5-6-9(10,11)12/h7,14H,5-6,13H2,1-4H3
InChIKeyXRKHUFYMWPRSQL-UHFFFAOYSA-N
XLogP1.50
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.50
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 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine?
The IUPAC name of 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine (CID 105238816) is 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine.
What is the SMILES notation for 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine?
The canonical SMILES for 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine is CN(C)C(C)(C)C(CCC(F)(F)F)NN.
What is the InChIKey of 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine?
The InChIKey is XRKHUFYMWPRSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20F3N3/c1-8(2,15(3)4)7(14-13)5-6-9(10,11)12/h7,14H,5-6,13H2,1-4H3.
What are the key properties of 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine?
6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine has a molecular weight of 227.27 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,6-trifluoro-3-hydrazinyl-N,N,2-trimethylhexan-2-amine is sourced from PubChem (CID 105238816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).