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

C16H19BrN2O — CID 105202710

IUPAC[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
SMILESCCOc1ccc(C(Cc2cccc(Br)c2)NN)cc1
InChIInChI=1S/C16H19BrN2O/c1-2-20-15-8-6-13(7-9-15)16(19-18)11-12-4-3-5-14(17)10-12/h3-10,16,19H,2,11,18H2,1H3
InChIKeyFCRVJZQTQOEFNT-UHFFFAOYSA-N
MW335.25 g/mol
LogP3.59
Rot. Bonds6

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

[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine (PubChem CID 105202710) has the molecular formula C16H19BrN2O and a molecular weight of 335.25 g/mol. Its IUPAC name is [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
PubChem CID105202710
Molecular FormulaC16H19BrN2O
Molecular Weight335.25 g/mol
Exact Mass334.07
IUPAC Name[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
SMILESCCOc1ccc(C(Cc2cccc(Br)c2)NN)cc1
InChIInChI=1S/C16H19BrN2O/c1-2-20-15-8-6-13(7-9-15)16(19-18)11-12-4-3-5-14(17)10-12/h3-10,16,19H,2,11,18H2,1H3
InChIKeyFCRVJZQTQOEFNT-UHFFFAOYSA-N
XLogP3.59
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.25
LogP ≤ 53.59
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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Frequently Asked Questions

What is the IUPAC name of [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine (CID 105202710) is [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine is CCOc1ccc(C(Cc2cccc(Br)c2)NN)cc1.
What is the InChIKey of [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine?
The InChIKey is FCRVJZQTQOEFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2O/c1-2-20-15-8-6-13(7-9-15)16(19-18)11-12-4-3-5-14(17)10-12/h3-10,16,19H,2,11,18H2,1H3.
What are the key properties of [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine?
[2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine has a molecular weight of 335.25 g/mol, XLogP of 3.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105202710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).