[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine

C15H15BrClFN2 — CID 102868674

IUPAC[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2cccc(Cl)c2F)NN)c(Br)c1
InChIInChI=1S/C15H15BrClFN2/c1-9-5-6-11(12(16)7-9)14(20-19)8-10-3-2-4-13(17)15(10)18/h2-7,14,20H,8,19H2,1H3
InChIKeyJQUSDIGLRFMRSD-UHFFFAOYSA-N
MW357.65 g/mol
LogP4.30
Rot. Bonds4

About [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine

[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine (PubChem CID 102868674) has the molecular formula C15H15BrClFN2 and a molecular weight of 357.65 g/mol. Its IUPAC name is [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
PubChem CID102868674
Molecular FormulaC15H15BrClFN2
Molecular Weight357.65 g/mol
Exact Mass356.01
IUPAC Name[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2cccc(Cl)c2F)NN)c(Br)c1
InChIInChI=1S/C15H15BrClFN2/c1-9-5-6-11(12(16)7-9)14(20-19)8-10-3-2-4-13(17)15(10)18/h2-7,14,20H,8,19H2,1H3
InChIKeyJQUSDIGLRFMRSD-UHFFFAOYSA-N
XLogP4.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.65
LogP ≤ 54.30
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-4-chlorophenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 107997395
[1-(2-bromo-4-methylphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
CID 105289027
[1-(2-bromo-4-methylphenyl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105284694
[2-(4-bromo-2-chlorophenyl)-1-(2-bromo-4-methylphenyl)ethyl]hydrazine
CID 105335180
[1-(3-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 102868845
2-(3-chloro-2-fluorophenyl)-1-(2-chloro-4-methylphenyl)-N-methylethanamine
CID 106858929
[1-(2-bromo-5-methylphenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 105286618
[1-(2-chloro-5-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine
CID 105397954
1-(2-bromo-4-methylphenyl)-2-(2-chloro-3-fluorophenyl)-N-methylethanamine
CID 105032435
3-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-5-methylpyridin-2-amine
CID 105264497
[2-(3-chloro-2-fluorophenyl)-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105264357
[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
CID 105285025

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine (CID 102868674) is [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine is Cc1ccc(C(Cc2cccc(Cl)c2F)NN)c(Br)c1.
What is the InChIKey of [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine?
The InChIKey is JQUSDIGLRFMRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2/c1-9-5-6-11(12(16)7-9)14(20-19)8-10-3-2-4-13(17)15(10)18/h2-7,14,20H,8,19H2,1H3.
What are the key properties of [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine?
[1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine has a molecular weight of 357.65 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-methylphenyl)-2-(3-chloro-2-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 102868674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).