[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine

C16H19BrN2O — CID 105289476

IUPAC[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccccc1CC(NN)c1cccc(Br)c1C
InChIInChI=1S/C16H19BrN2O/c1-11-13(7-5-8-14(11)17)15(19-18)10-12-6-3-4-9-16(12)20-2/h3-9,15,19H,10,18H2,1-2H3
InChIKeyWAUXBTYXOPLABP-UHFFFAOYSA-N
MW335.25 g/mol
LogP3.51
Rot. Bonds5

About [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine

[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine (PubChem CID 105289476) has the molecular formula C16H19BrN2O and a molecular weight of 335.25 g/mol. Its IUPAC name is [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine
PubChem CID105289476
Molecular FormulaC16H19BrN2O
Molecular Weight335.25 g/mol
Exact Mass334.07
IUPAC Name[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccccc1CC(NN)c1cccc(Br)c1C
InChIInChI=1S/C16H19BrN2O/c1-11-13(7-5-8-14(11)17)15(19-18)10-12-6-3-4-9-16(12)20-2/h3-9,15,19H,10,18H2,1-2H3
InChIKeyWAUXBTYXOPLABP-UHFFFAOYSA-N
XLogP3.51
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.25
LogP ≤ 53.51
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 [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine (CID 105289476) is [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine is COc1ccccc1CC(NN)c1cccc(Br)c1C.
What is the InChIKey of [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine?
The InChIKey is WAUXBTYXOPLABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2O/c1-11-13(7-5-8-14(11)17)15(19-18)10-12-6-3-4-9-16(12)20-2/h3-9,15,19H,10,18H2,1-2H3.
What are the key properties of [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine?
[1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine has a molecular weight of 335.25 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-2-methylphenyl)-2-(2-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105289476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).