[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

C14H11Br2F3N2 — CID 105301356

IUPAC[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(C(F)(F)F)c1)c1cc(Br)ccc1Br
InChIInChI=1S/C14H11Br2F3N2/c15-10-4-5-12(16)11(7-10)13(21-20)8-2-1-3-9(6-8)14(17,18)19/h1-7,13,21H,20H2
InChIKeyRTFCDRRBOUFTKH-UHFFFAOYSA-N
MW424.06 g/mol
LogP4.78
Rot. Bonds3

About [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105301356) has the molecular formula C14H11Br2F3N2 and a molecular weight of 424.06 g/mol. Its IUPAC name is [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105301356
Molecular FormulaC14H11Br2F3N2
Molecular Weight424.06 g/mol
Exact Mass421.92
IUPAC Name[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(C(F)(F)F)c1)c1cc(Br)ccc1Br
InChIInChI=1S/C14H11Br2F3N2/c15-10-4-5-12(16)11(7-10)13(21-20)8-2-1-3-9(6-8)14(17,18)19/h1-7,13,21H,20H2
InChIKeyRTFCDRRBOUFTKH-UHFFFAOYSA-N
XLogP4.78
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.06
LogP ≤ 54.78
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

[(2,4-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948178
[(2,5-dibromophenyl)-(3-methylphenyl)methyl]hydrazine
CID 105284904
[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301331
[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[(2,5-dibromophenyl)-(3-ethylphenyl)methyl]hydrazine
CID 105326320
[(2,5-dibromophenyl)-(3,5-difluorophenyl)methyl]hydrazine
CID 105301861
[(3-bromo-5-chlorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948177
[(2,5-dibromophenyl)-[3-(2-methylpropyl)phenyl]methyl]hydrazine
CID 105340701
[(2,5-dimethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193884
[(4-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105192836
[[4-bromo-2-(trifluoromethyl)phenyl]-(3-chlorophenyl)methyl]hydrazine
CID 105212866
(2-bromophenyl)-[3-(trifluoromethyl)phenyl]methanamine
CID 43825139

Frequently Asked Questions

What is the IUPAC name of [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105301356) is [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1cccc(C(F)(F)F)c1)c1cc(Br)ccc1Br.
What is the InChIKey of [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is RTFCDRRBOUFTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2F3N2/c15-10-4-5-12(16)11(7-10)13(21-20)8-2-1-3-9(6-8)14(17,18)19/h1-7,13,21H,20H2.
What are the key properties of [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 424.06 g/mol, XLogP of 4.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105301356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).