[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine

C14H13BrFIN2 — CID 105327029

IUPAC[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)c1cccc(I)c1
InChIInChI=1S/C14H13BrFIN2/c15-14-10(4-2-6-12(14)16)8-13(19-18)9-3-1-5-11(17)7-9/h1-7,13,19H,8,18H2
InChIKeyHRAQAGZFWDJLTI-UHFFFAOYSA-N
MW435.08 g/mol
LogP3.94
Rot. Bonds4

About [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine

[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine (PubChem CID 105327029) has the molecular formula C14H13BrFIN2 and a molecular weight of 435.08 g/mol. Its IUPAC name is [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine
PubChem CID105327029
Molecular FormulaC14H13BrFIN2
Molecular Weight435.08 g/mol
Exact Mass433.93
IUPAC Name[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)c1cccc(I)c1
InChIInChI=1S/C14H13BrFIN2/c15-14-10(4-2-6-12(14)16)8-13(19-18)9-3-1-5-11(17)7-9/h1-7,13,19H,8,18H2
InChIKeyHRAQAGZFWDJLTI-UHFFFAOYSA-N
XLogP3.94
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.08
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-(5-bromo-2-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105294855
[2-(2-bromo-3-fluorophenyl)-1-(4-bromo-3-fluorophenyl)ethyl]hydrazine
CID 105327124
[2-(2-bromophenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105283862
[2-(2-bromo-3-fluorophenyl)-1-(4-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105327080
[2-(4-bromophenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105284349
[2-(2-bromo-3-fluorophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
CID 105327049
[2-(2-bromo-5-methoxyphenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105309446
[2-(2-bromo-3-fluorophenyl)-1-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105222066
[2-(2-bromo-3-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105211530
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105327015
[2-(2-bromo-3-fluorophenyl)-1-(5-bromo-2-pyridinyl)ethyl]hydrazine
CID 105267678
[2-(4-ethylphenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105287837

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine (CID 105327029) is [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine is NNC(Cc1cccc(F)c1Br)c1cccc(I)c1.
What is the InChIKey of [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine?
The InChIKey is HRAQAGZFWDJLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrFIN2/c15-14-10(4-2-6-12(14)16)8-13(19-18)9-3-1-5-11(17)7-9/h1-7,13,19H,8,18H2.
What are the key properties of [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine?
[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine has a molecular weight of 435.08 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine is sourced from PubChem (CID 105327029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).