[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine

C13H15BrN2OS — CID 105304440

IUPAC[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)c1csc(Br)c1
InChIInChI=1S/C13H15BrN2OS/c1-2-17-11-6-4-3-5-10(11)13(16-15)9-7-12(14)18-8-9/h3-8,13,16H,2,15H2,1H3
InChIKeyIWGCSOXUOZPQID-UHFFFAOYSA-N
MW327.25 g/mol
LogP3.46
Rot. Bonds5

About [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine

[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine (PubChem CID 105304440) has the molecular formula C13H15BrN2OS and a molecular weight of 327.25 g/mol. Its IUPAC name is [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
PubChem CID105304440
Molecular FormulaC13H15BrN2OS
Molecular Weight327.25 g/mol
Exact Mass326.01
IUPAC Name[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)c1csc(Br)c1
InChIInChI=1S/C13H15BrN2OS/c1-2-17-11-6-4-3-5-10(11)13(16-15)9-7-12(14)18-8-9/h3-8,13,16H,2,15H2,1H3
InChIKeyIWGCSOXUOZPQID-UHFFFAOYSA-N
XLogP3.46
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.25
LogP ≤ 53.46
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'}

Analyze [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3,5-dimethylphenyl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105260811
[(2-ethoxyphenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105260722
[(2-ethoxyphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105192906
[(2-ethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105260791
[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 107970267
[(2,5-dibromothiophen-3-yl)-(2-propoxyphenyl)methyl]hydrazine
CID 107970581
[(2-ethoxyphenyl)-pyridin-2-ylmethyl]hydrazine
CID 105195729
[(5-chlorofuran-2-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 106694388
[(3,5-dibromophenyl)-(2-methoxyphenyl)methyl]hydrazine
CID 114023418
[(2-ethoxyphenyl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 105268919
[(2-ethoxyphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105260703
[(2-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methyl]hydrazine
CID 105304374

Frequently Asked Questions

What is the IUPAC name of [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine (CID 105304440) is [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine is CCOc1ccccc1C(NN)c1csc(Br)c1.
What is the InChIKey of [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The InChIKey is IWGCSOXUOZPQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2OS/c1-2-17-11-6-4-3-5-10(11)13(16-15)9-7-12(14)18-8-9/h3-8,13,16H,2,15H2,1H3.
What are the key properties of [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine has a molecular weight of 327.25 g/mol, XLogP of 3.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105304440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).