[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

C16H18BrClN2 — CID 114027312

IUPAC[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2cc(Cl)ccc2Br)c1
InChIInChI=1S/C16H18BrClN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-9-13(18)3-4-15(14)17/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyKSPPXDWAQMMTQV-UHFFFAOYSA-N
MW353.69 g/mol
LogP4.47
Rot. Bonds4

About [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 114027312) has the molecular formula C16H18BrClN2 and a molecular weight of 353.69 g/mol. Its IUPAC name is [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
PubChem CID114027312
Molecular FormulaC16H18BrClN2
Molecular Weight353.69 g/mol
Exact Mass352.03
IUPAC Name[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2cc(Cl)ccc2Br)c1
InChIInChI=1S/C16H18BrClN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-9-13(18)3-4-15(14)17/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyKSPPXDWAQMMTQV-UHFFFAOYSA-N
XLogP4.47
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.69
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(2-bromo-5-chlorophenyl)-2-(3-chlorophenyl)ethyl]hydrazine
CID 114027293
[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105280879
[1-(2-chloro-3-methylphenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105287257
[1-(2-bromo-5-methylphenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105290064
[1-(2-bromo-4-chlorophenyl)-2-phenylethyl]hydrazine
CID 107996633
[1-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)ethyl]hydrazine
CID 114028413
[1-(2,5-dichlorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105292704
[2-(3,5-dimethylphenyl)-1-(2-methoxy-4-methylphenyl)ethyl]hydrazine
CID 106793855
[1-(2-bromo-5-methylphenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 105286618
[2-(3-bromo-2,6-difluorophenyl)-1-(2-bromo-5-methylphenyl)ethyl]hydrazine
CID 106271871
[2-(2-bromo-5-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 105297127
[1-(3,5-dibromophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 107978906

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (CID 114027312) is [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is Cc1cc(C)cc(CC(NN)c2cc(Cl)ccc2Br)c1.
What is the InChIKey of [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is KSPPXDWAQMMTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrClN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-9-13(18)3-4-15(14)17/h3-7,9,16,20H,8,19H2,1-2H3.
What are the key properties of [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 353.69 g/mol, XLogP of 4.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 114027312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).