[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine

C15H16BrFN2O — CID 105264052

IUPAC[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)c2ccc(F)c(Br)c2)cc1
InChIInChI=1S/C15H16BrFN2O/c1-2-20-12-6-3-10(4-7-12)15(19-18)11-5-8-14(17)13(16)9-11/h3-9,15,19H,2,18H2,1H3
InChIKeyQCVCJEOVGUHXTL-UHFFFAOYSA-N
MW339.21 g/mol
LogP3.54
Rot. Bonds5

About [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine

[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine (PubChem CID 105264052) has the molecular formula C15H16BrFN2O and a molecular weight of 339.21 g/mol. Its IUPAC name is [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine
PubChem CID105264052
Molecular FormulaC15H16BrFN2O
Molecular Weight339.21 g/mol
Exact Mass338.04
IUPAC Name[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)c2ccc(F)c(Br)c2)cc1
InChIInChI=1S/C15H16BrFN2O/c1-2-20-12-6-3-10(4-7-12)15(19-18)11-5-8-14(17)13(16)9-11/h3-9,15,19H,2,18H2,1H3
InChIKeyQCVCJEOVGUHXTL-UHFFFAOYSA-N
XLogP3.54
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.21
LogP ≤ 53.54
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

[(3-bromo-4-methoxyphenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300768
N-[1-(3-bromo-4-fluorophenyl)ethyl]-4-ethoxyaniline
CID 43757906
[(2,5-dibromophenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300739
[(4-ethoxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194292
[(3-bromo-4-fluorophenyl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105264229
[(4-ethoxyphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288044
5-chloro-2-[(4-ethoxyphenyl)-hydrazinylmethyl]aniline
CID 105224096
2-(3-bromo-4-fluorophenyl)-1-(4-ethoxyphenyl)-N-methylethanamine
CID 115818655
[(3-bromo-4-fluorophenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105264062
[(3-bromo-4-fluorophenyl)-(2-chlorophenyl)methyl]hydrazine
CID 105263983
N-[(5-bromo-2-fluorophenyl)-(4-ethoxyphenyl)methyl]ethanamine
CID 43489424
[(2-bromo-5-fluorophenyl)-(4-propoxyphenyl)methyl]hydrazine
CID 105303709

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine (CID 105264052) is [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine is CCOc1ccc(C(NN)c2ccc(F)c(Br)c2)cc1.
What is the InChIKey of [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine?
The InChIKey is QCVCJEOVGUHXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrFN2O/c1-2-20-12-6-3-10(4-7-12)15(19-18)11-5-8-14(17)13(16)9-11/h3-9,15,19H,2,18H2,1H3.
What are the key properties of [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine?
[(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine has a molecular weight of 339.21 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-4-fluorophenyl)-(4-ethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105264052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).