[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine

C17H20BrFN2 — CID 105264214

IUPAC[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c(CC(NN)c2ccc(F)c(Br)c2)c(C)c1
InChIInChI=1S/C17H20BrFN2/c1-10-6-11(2)14(12(3)7-10)9-17(21-20)13-4-5-16(19)15(18)8-13/h4-8,17,21H,9,20H2,1-3H3
InChIKeyHGNFJLWRYBKOGS-UHFFFAOYSA-N
MW351.26 g/mol
LogP4.26
Rot. Bonds4

About [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine

[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine (PubChem CID 105264214) has the molecular formula C17H20BrFN2 and a molecular weight of 351.26 g/mol. Its IUPAC name is [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
PubChem CID105264214
Molecular FormulaC17H20BrFN2
Molecular Weight351.26 g/mol
Exact Mass350.08
IUPAC Name[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c(CC(NN)c2ccc(F)c(Br)c2)c(C)c1
InChIInChI=1S/C17H20BrFN2/c1-10-6-11(2)14(12(3)7-10)9-17(21-20)13-4-5-16(19)15(18)8-13/h4-8,17,21H,9,20H2,1-3H3
InChIKeyHGNFJLWRYBKOGS-UHFFFAOYSA-N
XLogP4.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.26
LogP ≤ 54.26
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-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105264141
[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
CID 105290439
[1-(4-ethylphenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105197487
[2-(2,6-difluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204208
[1-(2-bromophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105208762
[1-(2-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105216946
[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105218179
[1-(3-bromo-4-fluorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105264219
[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105292719
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329211
[1-(3,4-difluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105197059
[2-(2-bromo-4-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204048

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine (CID 105264214) is [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine is Cc1cc(C)c(CC(NN)c2ccc(F)c(Br)c2)c(C)c1.
What is the InChIKey of [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The InChIKey is HGNFJLWRYBKOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20BrFN2/c1-10-6-11(2)14(12(3)7-10)9-17(21-20)13-4-5-16(19)15(18)8-13/h4-8,17,21H,9,20H2,1-3H3.
What are the key properties of [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine has a molecular weight of 351.26 g/mol, XLogP of 4.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105264214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).