[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine

C16H19BrN2O2 — CID 105192188

IUPAC[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cccc(Br)c2)NN)cc1OC
InChIInChI=1S/C16H19BrN2O2/c1-20-15-7-6-12(10-16(15)21-2)14(19-18)9-11-4-3-5-13(17)8-11/h3-8,10,14,19H,9,18H2,1-2H3
InChIKeyRWXSXUYXOIEVFK-UHFFFAOYSA-N
MW351.24 g/mol
LogP3.21
Rot. Bonds6

About [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine

[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine (PubChem CID 105192188) has the molecular formula C16H19BrN2O2 and a molecular weight of 351.24 g/mol. Its IUPAC name is [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine
PubChem CID105192188
Molecular FormulaC16H19BrN2O2
Molecular Weight351.24 g/mol
Exact Mass350.06
IUPAC Name[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cccc(Br)c2)NN)cc1OC
InChIInChI=1S/C16H19BrN2O2/c1-20-15-7-6-12(10-16(15)21-2)14(19-18)9-11-4-3-5-13(17)8-11/h3-8,10,14,19H,9,18H2,1-2H3
InChIKeyRWXSXUYXOIEVFK-UHFFFAOYSA-N
XLogP3.21
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.24
LogP ≤ 53.21
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

[1-(3,4-dimethoxyphenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105192122
[2-(3-bromophenyl)-1-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105202744
[2-(5-bromo-2-methoxyphenyl)-1-(3-bromophenyl)ethyl]hydrazine
CID 105198026
2-(3-bromophenyl)-N-ethyl-1-(4-methoxy-3-methylphenyl)ethanamine
CID 63503341
1-(3-bromo-4-methoxyphenyl)-2-(3-bromophenyl)-N-ethylethanamine
CID 63509459
[1-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105192119
[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
CID 105202710
[1-(4-bromo-3-methylphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295298
[2-(3-bromophenyl)-1-(4-methylsulfonylphenyl)ethyl]hydrazine
CID 105284506
[2-(3-methoxyphenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190967
[2-(3-bromo-5-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105324861
[1-(3-fluoro-4-methoxyphenyl)-2-phenylethyl]hydrazine
CID 105195319

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine (CID 105192188) is [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine is COc1ccc(C(Cc2cccc(Br)c2)NN)cc1OC.
What is the InChIKey of [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine?
The InChIKey is RWXSXUYXOIEVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2O2/c1-20-15-7-6-12(10-16(15)21-2)14(19-18)9-11-4-3-5-13(17)8-11/h3-8,10,14,19H,9,18H2,1-2H3.
What are the key properties of [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine?
[2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine has a molecular weight of 351.24 g/mol, XLogP of 3.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromophenyl)-1-(3,4-dimethoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105192188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).