[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine

C15H15BrF2N2O — CID 105288951

IUPAC[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(F)ccc2F)NN)cc1Br
InChIInChI=1S/C15H15BrF2N2O/c1-21-15-5-2-9(7-12(15)16)14(20-19)8-10-6-11(17)3-4-13(10)18/h2-7,14,20H,8,19H2,1H3
InChIKeyDUXATXFPOYOVME-UHFFFAOYSA-N
MW357.20 g/mol
LogP3.48
Rot. Bonds5

About [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine

[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine (PubChem CID 105288951) has the molecular formula C15H15BrF2N2O and a molecular weight of 357.20 g/mol. Its IUPAC name is [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
PubChem CID105288951
Molecular FormulaC15H15BrF2N2O
Molecular Weight357.20 g/mol
Exact Mass356.03
IUPAC Name[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(F)ccc2F)NN)cc1Br
InChIInChI=1S/C15H15BrF2N2O/c1-21-15-5-2-9(7-12(15)16)14(20-19)8-10-6-11(17)3-4-13(10)18/h2-7,14,20H,8,19H2,1H3
InChIKeyDUXATXFPOYOVME-UHFFFAOYSA-N
XLogP3.48
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.20
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[1-(3-bromo-4-methoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340895
[1-(3-bromo-4-methoxyphenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105295115
[1-(3-bromo-4-methoxyphenyl)-2-(2-bromophenyl)ethyl]hydrazine
CID 105283965
[1-(4-bromo-3-chlorophenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
CID 105288913
[1-(4-fluoro-3-methoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340825
[1-(4-bromo-3-fluorophenyl)-2-(5-chloro-2-methoxyphenyl)ethyl]hydrazine
CID 105297604
[2-(3-bromo-4-methoxyphenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105203976
[2-(2-bromo-5-fluorophenyl)-1-(3,4-difluorophenyl)ethyl]hydrazine
CID 105197170
[2-(2,5-difluorophenyl)-1-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105194039
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329211
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 105293177
[2-(2-bromo-4-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204048

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine (CID 105288951) is [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine is COc1ccc(C(Cc2cc(F)ccc2F)NN)cc1Br.
What is the InChIKey of [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine?
The InChIKey is DUXATXFPOYOVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrF2N2O/c1-21-15-5-2-9(7-12(15)16)14(20-19)8-10-6-11(17)3-4-13(10)18/h2-7,14,20H,8,19H2,1H3.
What are the key properties of [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine?
[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine has a molecular weight of 357.20 g/mol, XLogP of 3.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105288951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).