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

C13H14BrN3O — CID 105267769

IUPAC[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccc(Br)cn2)c1
InChIInChI=1S/C13H14BrN3O/c1-18-11-4-2-3-9(7-11)13(17-15)12-6-5-10(14)8-16-12/h2-8,13,17H,15H2,1H3
InChIKeyUEYKCWCDBMBHLF-UHFFFAOYSA-N
MW308.18 g/mol
LogP2.41
Rot. Bonds4

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

[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine (PubChem CID 105267769) has the molecular formula C13H14BrN3O and a molecular weight of 308.18 g/mol. Its IUPAC name is [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
PubChem CID105267769
Molecular FormulaC13H14BrN3O
Molecular Weight308.18 g/mol
Exact Mass307.03
IUPAC Name[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)c2ccc(Br)cn2)c1
InChIInChI=1S/C13H14BrN3O/c1-18-11-4-2-3-9(7-11)13(17-15)12-6-5-10(14)8-16-12/h2-8,13,17H,15H2,1H3
InChIKeyUEYKCWCDBMBHLF-UHFFFAOYSA-N
XLogP2.41
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 52.41
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

[(5-bromo-2-pyridinyl)-(3-methylphenyl)methyl]hydrazine
CID 105267734
[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 114033147
[(4-bromo-2-fluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105280937
[(3-methoxyphenyl)-phenylmethyl]hydrazine
CID 105191567
[(4-bromo-2,6-difluorophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283689
[(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283642
[(2-bromophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105208659
[(3,5-dimethoxypyrazin-2-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105332206
[(5-bromo-2-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methyl]hydrazine
CID 105267904
[(4-bromo-1-propan-2-ylpyrazol-5-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191592
[(5-fluoro-3-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105191767

Frequently Asked Questions

What is the IUPAC name of [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine (CID 105267769) is [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine is COc1cccc(C(NN)c2ccc(Br)cn2)c1.
What is the InChIKey of [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine?
The InChIKey is UEYKCWCDBMBHLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3O/c1-18-11-4-2-3-9(7-11)13(17-15)12-6-5-10(14)8-16-12/h2-8,13,17H,15H2,1H3.
What are the key properties of [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine?
[(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine has a molecular weight of 308.18 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromo-2-pyridinyl)-(3-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105267769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).