[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine

C15H12BrFN2O — CID 105262493

IUPAC[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
SMILESNNC(c1cc(Br)ccc1F)c1coc2ccccc12
InChIInChI=1S/C15H12BrFN2O/c16-9-5-6-13(17)11(7-9)15(19-18)12-8-20-14-4-2-1-3-10(12)14/h1-8,15,19H,18H2
InChIKeyFVHZKLLRAYNASS-UHFFFAOYSA-N
MW335.18 g/mol
LogP3.89
Rot. Bonds3

About [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine

[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine (PubChem CID 105262493) has the molecular formula C15H12BrFN2O and a molecular weight of 335.18 g/mol. Its IUPAC name is [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
PubChem CID105262493
Molecular FormulaC15H12BrFN2O
Molecular Weight335.18 g/mol
Exact Mass334.01
IUPAC Name[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
SMILESNNC(c1cc(Br)ccc1F)c1coc2ccccc12
InChIInChI=1S/C15H12BrFN2O/c16-9-5-6-13(17)11(7-9)15(19-18)12-8-20-14-4-2-1-3-10(12)14/h1-8,15,19H,18H2
InChIKeyFVHZKLLRAYNASS-UHFFFAOYSA-N
XLogP3.89
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.18
LogP ≤ 53.89
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

[(5-bromo-2-fluorophenyl)-(3-bromofuran-2-yl)methyl]hydrazine
CID 105280775
[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105262495
[(5-bromo-2-fluorophenyl)-isoquinolin-1-ylmethyl]hydrazine
CID 105220642
[1-benzofuran-3-yl-(2-fluoro-3-methoxyphenyl)methyl]hydrazine
CID 105262431
[(5-bromo-2-fluorophenyl)-isoquinolin-5-ylmethyl]hydrazine
CID 105280719
[1-benzofuran-3-yl(thiophen-2-yl)methyl]hydrazine
CID 105262414
[(5-bromo-2-fluorophenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194403
4-bromo-2-[(2-fluoro-5-methylphenyl)-hydrazinylmethyl]aniline
CID 105263411
1-(1-benzofuran-3-yl)-1-(3-bromo-2,6-difluorophenyl)-N-methylmethanamine
CID 106942961
[1-benzothiophen-7-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine
CID 105280614
[(5-bromo-2-fluorophenyl)-pyridin-3-ylmethyl]hydrazine
CID 105196222
[(5-bromo-2-fluorophenyl)-(4-bromo-3-methylphenyl)methyl]hydrazine
CID 105323074

Frequently Asked Questions

What is the IUPAC name of [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine?
The IUPAC name of [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine (CID 105262493) is [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine is NNC(c1cc(Br)ccc1F)c1coc2ccccc12.
What is the InChIKey of [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine?
The InChIKey is FVHZKLLRAYNASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrFN2O/c16-9-5-6-13(17)11(7-9)15(19-18)12-8-20-14-4-2-1-3-10(12)14/h1-8,15,19H,18H2.
What are the key properties of [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine?
[1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine has a molecular weight of 335.18 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzofuran-3-yl-(5-bromo-2-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105262493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).