[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine

C16H18BrClN2O — CID 105309443

IUPAC[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(Br)c(CC(NN)c2cc(C)cc(Cl)c2)c1
InChIInChI=1S/C16H18BrClN2O/c1-10-5-12(7-13(18)6-10)16(20-19)9-11-8-14(21-2)3-4-15(11)17/h3-8,16,20H,9,19H2,1-2H3
InChIKeyXVHRTCOFRGATEX-UHFFFAOYSA-N
MW369.69 g/mol
LogP4.17
Rot. Bonds5

About [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine

[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine (PubChem CID 105309443) has the molecular formula C16H18BrClN2O and a molecular weight of 369.69 g/mol. Its IUPAC name is [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine
PubChem CID105309443
Molecular FormulaC16H18BrClN2O
Molecular Weight369.69 g/mol
Exact Mass368.03
IUPAC Name[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(Br)c(CC(NN)c2cc(C)cc(Cl)c2)c1
InChIInChI=1S/C16H18BrClN2O/c1-10-5-12(7-13(18)6-10)16(20-19)9-11-8-14(21-2)3-4-15(11)17/h3-8,16,20H,9,19H2,1-2H3
InChIKeyXVHRTCOFRGATEX-UHFFFAOYSA-N
XLogP4.17
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.69
LogP ≤ 54.17
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

[2-(2-bromo-5-methoxyphenyl)-1-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105309449
[2-(2-bromo-5-methoxyphenyl)-1-(furan-3-yl)ethyl]hydrazine
CID 105221324
[2-(2-bromo-5-methoxyphenyl)-1-(2-chloro-3-methylphenyl)ethyl]hydrazine
CID 105309533
[2-(2-bromo-5-methoxyphenyl)-1-(5-bromo-3-pyridinyl)ethyl]hydrazine
CID 105251145
[2-(2-bromo-5-methoxyphenyl)-1-(3-iodophenyl)ethyl]hydrazine
CID 105309446
2-(2-bromo-5-methoxyphenyl)-1-(4-chlorophenyl)-N-methylethanamine
CID 65325450
[2-(2-bromo-5-methoxyphenyl)-1-(2-chloro-4-fluorophenyl)ethyl]hydrazine
CID 105215387
[2-(5-chloro-2-methoxyphenyl)-1-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105297599
2-(2-bromo-5-methoxyphenyl)-1-(5-chloro-2-methylphenyl)-N-methylethanamine
CID 115862271
[2-(2-bromo-5-methoxyphenyl)-1-(5-ethylfuran-2-yl)ethyl]hydrazine
CID 105309525
[2-(2-bromo-5-methoxyphenyl)-1-(1H-1,2,4-triazol-5-yl)ethyl]hydrazine
CID 105230474
[1-(2-bromo-5-methoxyphenyl)-2-(4-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105342752

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine (CID 105309443) is [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine is COc1ccc(Br)c(CC(NN)c2cc(C)cc(Cl)c2)c1.
What is the InChIKey of [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine?
The InChIKey is XVHRTCOFRGATEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrClN2O/c1-10-5-12(7-13(18)6-10)16(20-19)9-11-8-14(21-2)3-4-15(11)17/h3-8,16,20H,9,19H2,1-2H3.
What are the key properties of [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine?
[2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine has a molecular weight of 369.69 g/mol, XLogP of 4.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-5-methoxyphenyl)-1-(3-chloro-5-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105309443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).