[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine

C11H15F3N2 — CID 124633921

IUPAC[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c([C@H](NN)C(F)(F)F)c(C)c1
InChIInChI=1S/C11H15F3N2/c1-6-4-7(2)9(8(3)5-6)10(16-15)11(12,13)14/h4-5,10,16H,15H2,1-3H3/t10-/m0/s1
InChIKeySPQDQDAGNIQONW-JTQLQIEISA-N
MW232.25 g/mol
LogP2.68
Rot. Bonds2

About [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine

[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine (PubChem CID 124633921) has the molecular formula C11H15F3N2 and a molecular weight of 232.25 g/mol. Its IUPAC name is [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
PubChem CID124633921
Molecular FormulaC11H15F3N2
Molecular Weight232.25 g/mol
Exact Mass232.12
IUPAC Name[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c([C@H](NN)C(F)(F)F)c(C)c1
InChIInChI=1S/C11H15F3N2/c1-6-4-7(2)9(8(3)5-6)10(16-15)11(12,13)14/h4-5,10,16H,15H2,1-3H3/t10-/m0/s1
InChIKeySPQDQDAGNIQONW-JTQLQIEISA-N
XLogP2.68
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 52.68
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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Related Compounds

[4,4,4-trifluoro-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105313895
[1,1,1-trifluoro-3-(2,4,6-trimethylphenyl)propan-2-yl]hydrazine
CID 105215820
[2-ethyl-1-(2-fluoro-4,6-dimethylphenyl)-2-methoxybutyl]hydrazine
CID 106884445
N,2,2-trimethyl-1-(2,4,6-trimethylphenyl)propane-1,3-diamine
CID 116949010
[1-(2-methoxy-4,6-dimethylphenyl)-2,2-dimethylbutyl]hydrazine
CID 106682971
1-(2,4,6-trimethylphenyl)butylhydrazine
CID 105282251
[3-methyl-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105282755
[1-(2-fluoro-4,6-dimethylphenyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 106884466
[4-methyl-1-(2,4,6-trimethylphenyl)pentyl]hydrazine
CID 105294214
5,5,5-trifluoro-1-(2,4,6-trimethylphenyl)pentan-1-amine
CID 105024104
[1-(2-fluoro-4,6-dimethylphenyl)-2-methylbutyl]hydrazine
CID 106884293
3,3,3-trifluoro-1-(2-fluoro-4,6-dimethylphenyl)propan-1-amine
CID 106881387

Frequently Asked Questions

What is the IUPAC name of [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The IUPAC name of [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine (CID 124633921) is [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine is Cc1cc(C)c([C@H](NN)C(F)(F)F)c(C)c1.
What is the InChIKey of [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The InChIKey is SPQDQDAGNIQONW-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15F3N2/c1-6-4-7(2)9(8(3)5-6)10(16-15)11(12,13)14/h4-5,10,16H,15H2,1-3H3/t10-/m0/s1.
What are the key properties of [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine?
[(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine has a molecular weight of 232.25 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 124633921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).