[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine

C15H14Br2N2O — CID 107948484

IUPAC[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)CCO2)c1ccc(Br)cc1Br
InChIInChI=1S/C15H14Br2N2O/c16-11-2-3-12(13(17)8-11)15(19-18)10-1-4-14-9(7-10)5-6-20-14/h1-4,7-8,15,19H,5-6,18H2
InChIKeyFPJSUSJJSTVORT-UHFFFAOYSA-N
MW398.10 g/mol
LogP3.70
Rot. Bonds3

About [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine

[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine (PubChem CID 107948484) has the molecular formula C15H14Br2N2O and a molecular weight of 398.10 g/mol. Its IUPAC name is [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
PubChem CID107948484
Molecular FormulaC15H14Br2N2O
Molecular Weight398.10 g/mol
Exact Mass395.95
IUPAC Name[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)CCO2)c1ccc(Br)cc1Br
InChIInChI=1S/C15H14Br2N2O/c16-11-2-3-12(13(17)8-11)15(19-18)10-1-4-14-9(7-10)5-6-20-14/h1-4,7-8,15,19H,5-6,18H2
InChIKeyFPJSUSJJSTVORT-UHFFFAOYSA-N
XLogP3.70
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.10
LogP ≤ 53.70
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-(2,5-dibromophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)-N-methylmethanamine
CID 62200884
[2,3-dihydro-1-benzofuran-5-yl-(2-iodophenyl)methyl]hydrazine
CID 105333859
[(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105211193
[(2-bromo-6-fluorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105280541
[(2-chlorofuran-3-yl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 106694707
[2,3-dihydro-1-benzofuran-5-yl-(2,5-dimethylfuran-3-yl)methyl]hydrazine
CID 105333855
[(2,5-difluorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105219495
[2,3-dihydro-1-benzofuran-5-yl-(2-methoxy-4-methylphenyl)methyl]hydrazine
CID 106794016
(2,4-dibromophenyl)-(3,4-dihydro-2H-chromen-6-yl)methanol
CID 107955593
[2,3-dihydro-1-benzofuran-5-yl-(2-fluoro-3-methylphenyl)methyl]hydrazine
CID 105333920
[(4-bromo-1-methylpyrazol-5-yl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105342182
[2,3-dihydro-1-benzofuran-5-yl-(5-ethylfuran-2-yl)methyl]hydrazine
CID 105333898

Frequently Asked Questions

What is the IUPAC name of [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine?
The IUPAC name of [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine (CID 107948484) is [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine.
What is the SMILES notation for [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine?
The canonical SMILES for [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine is NNC(c1ccc2c(c1)CCO2)c1ccc(Br)cc1Br.
What is the InChIKey of [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine?
The InChIKey is FPJSUSJJSTVORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Br2N2O/c16-11-2-3-12(13(17)8-11)15(19-18)10-1-4-14-9(7-10)5-6-20-14/h1-4,7-8,15,19H,5-6,18H2.
What are the key properties of [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine?
[(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine has a molecular weight of 398.10 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dibromophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine is sourced from PubChem (CID 107948484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).