[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine

C15H16Br2N2O2 — CID 107979050

IUPAC[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Br)cc(Br)c2)cc1OC
InChIInChI=1S/C15H16Br2N2O2/c1-20-13-4-3-9(7-14(13)21-2)15(19-18)10-5-11(16)8-12(17)6-10/h3-8,15,19H,18H2,1-2H3
InChIKeyLOLYXOWSTXOCCU-UHFFFAOYSA-N
MW416.11 g/mol
LogP3.78
Rot. Bonds5

About [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine

[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine (PubChem CID 107979050) has the molecular formula C15H16Br2N2O2 and a molecular weight of 416.11 g/mol. Its IUPAC name is [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
PubChem CID107979050
Molecular FormulaC15H16Br2N2O2
Molecular Weight416.11 g/mol
Exact Mass413.96
IUPAC Name[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Br)cc(Br)c2)cc1OC
InChIInChI=1S/C15H16Br2N2O2/c1-20-13-4-3-9(7-14(13)21-2)15(19-18)10-5-11(16)8-12(17)6-10/h3-8,15,19H,18H2,1-2H3
InChIKeyLOLYXOWSTXOCCU-UHFFFAOYSA-N
XLogP3.78
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.11
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105192317
[(3,4-dimethoxyphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192250
[(3-bromo-5-methylphenyl)-(4-chloro-3-methoxyphenyl)methyl]hydrazine
CID 105320733
[(5-bromo-2-methylphenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301110
[(3-bromo-5-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 107948201
[(3,5-dibromophenyl)-(2-methoxyphenyl)methyl]hydrazine
CID 114023418
1,3-dibromo-5-[bromo-(3,4-dimethoxyphenyl)methyl]benzene
CID 107980871
[(2-bromo-3-methylphenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 107986014
[(3,5-dibromophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
CID 107978842
[(4-chlorophenyl)-(3,5-dibromophenyl)methyl]hydrazine
CID 107978840
[(3,4-dimethoxyphenyl)-(3-methoxypyrazin-2-yl)methyl]hydrazine
CID 105192205
[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301093

Frequently Asked Questions

What is the IUPAC name of [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine (CID 107979050) is [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine is COc1ccc(C(NN)c2cc(Br)cc(Br)c2)cc1OC.
What is the InChIKey of [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The InChIKey is LOLYXOWSTXOCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Br2N2O2/c1-20-13-4-3-9(7-14(13)21-2)15(19-18)10-5-11(16)8-12(17)6-10/h3-8,15,19H,18H2,1-2H3.
What are the key properties of [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine has a molecular weight of 416.11 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 107979050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).