[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine

C10H11BrClF3N2 — CID 105313950

IUPAC[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine
SMILESNNC(CCC(F)(F)F)c1ccc(Br)cc1Cl
InChIInChI=1S/C10H11BrClF3N2/c11-6-1-2-7(8(12)5-6)9(17-16)3-4-10(13,14)15/h1-2,5,9,17H,3-4,16H2
InChIKeyNDAZDTDJOYPLHU-UHFFFAOYSA-N
MW331.56 g/mol
LogP3.95
Rot. Bonds4

About [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine

[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine (PubChem CID 105313950) has the molecular formula C10H11BrClF3N2 and a molecular weight of 331.56 g/mol. Its IUPAC name is [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine
PubChem CID105313950
Molecular FormulaC10H11BrClF3N2
Molecular Weight331.56 g/mol
Exact Mass329.97
IUPAC Name[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine
SMILESNNC(CCC(F)(F)F)c1ccc(Br)cc1Cl
InChIInChI=1S/C10H11BrClF3N2/c11-6-1-2-7(8(12)5-6)9(17-16)3-4-10(13,14)15/h1-2,5,9,17H,3-4,16H2
InChIKeyNDAZDTDJOYPLHU-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.56
LogP ≤ 53.95
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'}

Analyze [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-bromo-2-chlorophenyl)-N-ethyl-5,5,5-trifluoropentan-1-amine
CID 105023825
[1-(4-bromo-2-chlorophenyl)-3-methylsulfonylpropyl]hydrazine
CID 114985187
1-(4-bromo-2-chlorophenyl)but-3-enylhydrazine
CID 105289666
1-(4-bromo-2-chlorophenyl)-3-[methyl(3,3,3-trifluoropropyl)amino]propan-1-ol
CID 82781389
[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105296864
[1-(4-bromo-2-chlorophenyl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105340398
[1-(4-bromo-2-methylphenyl)-4,4-dimethylpentyl]hydrazine
CID 105299902
N-[1-(4-bromo-2-chlorophenyl)ethyl]-4,4,4-trifluorobutan-1-amine
CID 82774647
[1-(2,6-dichlorophenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313893
[1-[4-bromo-2-(trifluoromethyl)phenyl]-4-methoxy-4-methylpentyl]hydrazine
CID 103026706
[1-(3-chloro-4-methylphenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313900
(2R)-2-(4-bromo-2-chlorophenyl)-2-fluoroethanamine;hydrochloride
CID 175839042

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine?
The IUPAC name of [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine (CID 105313950) is [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine is NNC(CCC(F)(F)F)c1ccc(Br)cc1Cl.
What is the InChIKey of [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine?
The InChIKey is NDAZDTDJOYPLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClF3N2/c11-6-1-2-7(8(12)5-6)9(17-16)3-4-10(13,14)15/h1-2,5,9,17H,3-4,16H2.
What are the key properties of [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine?
[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine has a molecular weight of 331.56 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine is sourced from PubChem (CID 105313950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).