[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine

C13H15BrN2O2 — CID 105295409

IUPAC[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C13H15BrN2O2/c1-17-10-4-2-3-9(7-10)8-11(16-15)12-5-6-13(14)18-12/h2-7,11,16H,8,15H2,1H3
InChIKeyZISDWQCCEHKNHA-UHFFFAOYSA-N
MW311.18 g/mol
LogP2.80
Rot. Bonds5

About [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine

[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine (PubChem CID 105295409) has the molecular formula C13H15BrN2O2 and a molecular weight of 311.18 g/mol. Its IUPAC name is [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
PubChem CID105295409
Molecular FormulaC13H15BrN2O2
Molecular Weight311.18 g/mol
Exact Mass310.03
IUPAC Name[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ccc(Br)o2)c1
InChIInChI=1S/C13H15BrN2O2/c1-17-10-4-2-3-9(7-10)8-11(16-15)12-5-6-13(14)18-12/h2-7,11,16H,8,15H2,1H3
InChIKeyZISDWQCCEHKNHA-UHFFFAOYSA-N
XLogP2.80
TPSA60.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.18
LogP ≤ 52.80
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

[2-(3-methoxyphenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190967
[1-(3-bromo-4-fluorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105264219
[1-(4-bromo-3-methylphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295298
[1-(5-bromofuran-2-yl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105287279
[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105268203
[2-(3-methoxyphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
CID 105295350
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057
[1-(2-chlorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105205130
[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 105205136
[1-(2-ethylphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295404
[1-(5-bromofuran-2-yl)-2-(5-bromo-2-methoxyphenyl)ethyl]hydrazine
CID 105290206
N-[1-(5-chlorofuran-2-yl)-2-(3-methoxyphenyl)ethyl]propan-1-amine
CID 106687830

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine (CID 105295409) is [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine is COc1cccc(CC(NN)c2ccc(Br)o2)c1.
What is the InChIKey of [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine?
The InChIKey is ZISDWQCCEHKNHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O2/c1-17-10-4-2-3-9(7-10)8-11(16-15)12-5-6-13(14)18-12/h2-7,11,16H,8,15H2,1H3.
What are the key properties of [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine?
[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine has a molecular weight of 311.18 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105295409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).