[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine

C14H14BrIN2O — CID 114033147

IUPAC[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2cc(Br)ccc2I)c1
InChIInChI=1S/C14H14BrIN2O/c1-19-11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3
InChIKeyHJAFMSNACZRGBR-UHFFFAOYSA-N
MW433.09 g/mol
LogP3.62
Rot. Bonds4

About [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine

[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine (PubChem CID 114033147) has the molecular formula C14H14BrIN2O and a molecular weight of 433.09 g/mol. Its IUPAC name is [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine
PubChem CID114033147
Molecular FormulaC14H14BrIN2O
Molecular Weight433.09 g/mol
Exact Mass431.93
IUPAC Name[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2cc(Br)ccc2I)c1
InChIInChI=1S/C14H14BrIN2O/c1-19-11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3
InChIKeyHJAFMSNACZRGBR-UHFFFAOYSA-N
XLogP3.62
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.09
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(4-bromo-2-fluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105280937
[(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283642
[(2-bromophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105208659
[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105267769
[(2-bromo-5-fluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283657
[(3-methoxyphenyl)-phenylmethyl]hydrazine
CID 105191567
[(4-bromo-2,6-difluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283689
[(2-bromo-5-methoxyphenyl)-(3-ethoxyphenyl)methyl]hydrazine
CID 105328079
[(3-bromophenyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105197869
[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326447
[(3-methoxyphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102842607
[(2-fluoro-4-methylphenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283579

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine (CID 114033147) is [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine is COc1cccc(C(NN)c2cc(Br)ccc2I)c1.
What is the InChIKey of [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine?
The InChIKey is HJAFMSNACZRGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrIN2O/c1-19-11-4-2-3-9(7-11)14(18-17)12-8-10(15)5-6-13(12)16/h2-8,14,18H,17H2,1H3.
What are the key properties of [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine?
[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine has a molecular weight of 433.09 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 114033147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).