[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

C11H12BrFN4 — CID 105252067

IUPAC[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)c1ncc[nH]1
InChIInChI=1S/C11H12BrFN4/c12-10-7(2-1-3-8(10)13)6-9(17-14)11-15-4-5-16-11/h1-5,9,17H,6,14H2,(H,15,16)
InChIKeyISXHDZCVZLTYJL-UHFFFAOYSA-N
MW299.15 g/mol
LogP2.06
Rot. Bonds4

About [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (PubChem CID 105252067) has the molecular formula C11H12BrFN4 and a molecular weight of 299.15 g/mol. Its IUPAC name is [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
PubChem CID105252067
Molecular FormulaC11H12BrFN4
Molecular Weight299.15 g/mol
Exact Mass298.02
IUPAC Name[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)c1ncc[nH]1
InChIInChI=1S/C11H12BrFN4/c12-10-7(2-1-3-8(10)13)6-9(17-14)11-15-4-5-16-11/h1-5,9,17H,6,14H2,(H,15,16)
InChIKeyISXHDZCVZLTYJL-UHFFFAOYSA-N
XLogP2.06
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.15
LogP ≤ 52.06
H-Bond Donors ≤ 53
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

[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252342
[2-(2-bromo-3-fluorophenyl)-1-(5-bromo-2-pyridinyl)ethyl]hydrazine
CID 105267678
[2-(2-bromo-3-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethyl]hydrazine
CID 105260420
[2-(2-bromo-3-fluorophenyl)-1-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105222066
[2-(2-bromo-3-fluorophenyl)-1-(4-bromo-3-fluorophenyl)ethyl]hydrazine
CID 105327124
[2-(2-bromo-5-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252149
[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252049
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105327015
[2-(2-bromo-3-fluorophenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105327029
[2-(2-bromo-3-fluorophenyl)-1-(2-ethoxyphenyl)ethyl]hydrazine
CID 105260715
[2-(2-bromo-3-fluorophenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228625
[2-(2-bromo-3-fluorophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
CID 105327049

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (CID 105252067) is [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is NNC(Cc1cccc(F)c1Br)c1ncc[nH]1.
What is the InChIKey of [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The InChIKey is ISXHDZCVZLTYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrFN4/c12-10-7(2-1-3-8(10)13)6-9(17-14)11-15-4-5-16-11/h1-5,9,17H,6,14H2,(H,15,16).
What are the key properties of [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine has a molecular weight of 299.15 g/mol, XLogP of 2.06, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105252067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).