2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine

C9H10BrF3N2 — CID 107286484

IUPAC2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine
SMILESCN(C)Nc1cc(Br)ccc1C(F)(F)F
InChIInChI=1S/C9H10BrF3N2/c1-15(2)14-8-5-6(10)3-4-7(8)9(11,12)13/h3-5,14H,1-2H3
InChIKeyUOYSXKNAVQCJIW-UHFFFAOYSA-N
MW283.09 g/mol
LogP3.36
Rot. Bonds2

About 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine

2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine (PubChem CID 107286484) has the molecular formula C9H10BrF3N2 and a molecular weight of 283.09 g/mol. Its IUPAC name is 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine
PubChem CID107286484
Molecular FormulaC9H10BrF3N2
Molecular Weight283.09 g/mol
Exact Mass282.00
IUPAC Name2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine
SMILESCN(C)Nc1cc(Br)ccc1C(F)(F)F
InChIInChI=1S/C9H10BrF3N2/c1-15(2)14-8-5-6(10)3-4-7(8)9(11,12)13/h3-5,14H,1-2H3
InChIKeyUOYSXKNAVQCJIW-UHFFFAOYSA-N
XLogP3.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.09
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-propyl-2-(trifluoromethyl)aniline
CID 107285802
5-bromo-N-butyl-2-(trifluoromethyl)aniline
CID 107285846
4-N-[5-bromo-2-(trifluoromethyl)phenyl]-1-N-methylcyclohexane-1,4-diamine
CID 107286948
5-bromo-N-(2-ethoxy-2-methylpropyl)-2-(trifluoromethyl)aniline
CID 107286657
N-[5-bromo-2-(trifluoromethyl)phenyl]-4-methylbenzenesulfonamide
CID 169370041
5-bromo-N-(4-methylhexan-2-yl)-2-(trifluoromethyl)aniline
CID 107286355
5-bromo-N-[(3-bromophenyl)methyl]-2-(trifluoromethyl)aniline
CID 107286070
5-bromo-2-(trifluoromethyl)-N-(5,5,5-trifluoropentyl)aniline
CID 107286470
2-[[5-bromo-2-(trifluoromethyl)anilino]methyl]phenol
CID 107286631
N-[4-bromo-2-(trifluoromethyl)phenyl]-N',N'-dimethylethane-1,2-diamine
CID 54918575
4-[5-bromo-2-(trifluoromethyl)anilino]butan-1-ol
CID 107286675
5-bromo-N-(1-cyclohexylpropyl)-2-(trifluoromethyl)aniline
CID 107286207

Frequently Asked Questions

What is the IUPAC name of 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine?
The IUPAC name of 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine (CID 107286484) is 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine.
What is the SMILES notation for 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine?
The canonical SMILES for 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine is CN(C)Nc1cc(Br)ccc1C(F)(F)F.
What is the InChIKey of 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine?
The InChIKey is UOYSXKNAVQCJIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrF3N2/c1-15(2)14-8-5-6(10)3-4-7(8)9(11,12)13/h3-5,14H,1-2H3.
What are the key properties of 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine?
2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine has a molecular weight of 283.09 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-bromo-2-(trifluoromethyl)phenyl]-1,1-dimethylhydrazine is sourced from PubChem (CID 107286484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).