[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine

C13H11Br3FN3 — CID 105268470

IUPAC[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)ccc1Br)c1ncc(Br)cc1Br
InChIInChI=1S/C13H11Br3FN3/c14-8-5-11(16)13(19-6-8)12(20-18)4-7-3-9(17)1-2-10(7)15/h1-3,5-6,12,20H,4,18H2
InChIKeyXXADOPQVOGFCKC-UHFFFAOYSA-N
MW467.96 g/mol
LogP4.26
Rot. Bonds4

About [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine

[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine (PubChem CID 105268470) has the molecular formula C13H11Br3FN3 and a molecular weight of 467.96 g/mol. Its IUPAC name is [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine
PubChem CID105268470
Molecular FormulaC13H11Br3FN3
Molecular Weight467.96 g/mol
Exact Mass464.85
IUPAC Name[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)ccc1Br)c1ncc(Br)cc1Br
InChIInChI=1S/C13H11Br3FN3/c14-8-5-11(16)13(19-6-8)12(20-18)4-7-3-9(17)1-2-10(7)15/h1-3,5-6,12,20H,4,18H2
InChIKeyXXADOPQVOGFCKC-UHFFFAOYSA-N
XLogP4.26
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.96
LogP ≤ 54.26
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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Related Compounds

[1-(3,5-dibromo-2-pyridinyl)-2-(2-methoxyphenyl)ethyl]hydrazine
CID 105268540
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethyl]hydrazine
CID 105297058
[2-(2-bromo-5-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203759
[2-(2-bromo-5-fluorophenyl)-1-(2,4-dibromophenyl)ethyl]hydrazine
CID 107948135
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261623
[2-(2-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207928
[2-(4-chlorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine
CID 105268537
[2-(2-bromo-5-fluorophenyl)-1-(4-bromo-2-fluorophenyl)ethyl]hydrazine
CID 105280999
[1-(3,5-dibromo-2-pyridinyl)-2-(2,3-dihydro-1H-inden-5-yl)ethyl]hydrazine
CID 105268319
[2-(2-bromo-5-fluorophenyl)-1-(3,4-difluorophenyl)ethyl]hydrazine
CID 105197170
[1-(4-bromo-3-chlorophenyl)-2-(2-bromo-5-fluorophenyl)ethyl]hydrazine
CID 105297052
[2-(2-bromo-5-fluorophenyl)-1-(5-bromothiophen-3-yl)ethyl]hydrazine
CID 105297094

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine (CID 105268470) is [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine is NNC(Cc1cc(F)ccc1Br)c1ncc(Br)cc1Br.
What is the InChIKey of [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine?
The InChIKey is XXADOPQVOGFCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Br3FN3/c14-8-5-11(16)13(19-6-8)12(20-18)4-7-3-9(17)1-2-10(7)15/h1-3,5-6,12,20H,4,18H2.
What are the key properties of [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine?
[2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine has a molecular weight of 467.96 g/mol, XLogP of 4.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-5-fluorophenyl)-1-(3,5-dibromo-2-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105268470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).