[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine

C12H16BrFN2 — CID 105310116

IUPAC[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine
SMILESNNC(CC1CCC1)c1ccc(Br)c(F)c1
InChIInChI=1S/C12H16BrFN2/c13-10-5-4-9(7-11(10)14)12(16-15)6-8-2-1-3-8/h4-5,7-8,12,16H,1-3,6,15H2
InChIKeyWEYUZUNCAXQXNI-UHFFFAOYSA-N
MW287.18 g/mol
LogP3.28
Rot. Bonds4

About [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine

[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine (PubChem CID 105310116) has the molecular formula C12H16BrFN2 and a molecular weight of 287.18 g/mol. Its IUPAC name is [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine
PubChem CID105310116
Molecular FormulaC12H16BrFN2
Molecular Weight287.18 g/mol
Exact Mass286.05
IUPAC Name[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine
SMILESNNC(CC1CCC1)c1ccc(Br)c(F)c1
InChIInChI=1S/C12H16BrFN2/c13-10-5-4-9(7-11(10)14)12(16-15)6-8-2-1-3-8/h4-5,7-8,12,16H,1-3,6,15H2
InChIKeyWEYUZUNCAXQXNI-UHFFFAOYSA-N
XLogP3.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.18
LogP ≤ 53.28
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

[2-cyclopropyl-1-(3,4-difluorophenyl)ethyl]hydrazine
CID 105196978
[(4-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine
CID 105340166
[2-cyclobutyl-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207885
[1-(3-bromo-2,6-difluorophenyl)-2-cyclobutylethyl]hydrazine
CID 106945539
[2-cyclobutyl-1-(3,5-dibromophenyl)ethyl]hydrazine
CID 107979147
[1-(2-bromo-4-fluorophenyl)-2-cyclobutylethyl]hydrazine
CID 105310051
[2-cycloheptyl-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105301798
[2-cyclopentyl-1-(4-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105299048
1-(4-bromo-3-fluorophenyl)-N-ethyl-2-(oxan-4-yl)ethanamine
CID 115847063
[1-(3-bromo-4-fluorophenyl)-2-(3,3-difluorocyclopentyl)ethyl]hydrazine
CID 114225992
[1-(3-bromophenyl)-2-cyclohexylethyl]hydrazine
CID 105197948
[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine
CID 105310083

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine?
The IUPAC name of [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine (CID 105310116) is [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine is NNC(CC1CCC1)c1ccc(Br)c(F)c1.
What is the InChIKey of [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine?
The InChIKey is WEYUZUNCAXQXNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrFN2/c13-10-5-4-9(7-11(10)14)12(16-15)6-8-2-1-3-8/h4-5,7-8,12,16H,1-3,6,15H2.
What are the key properties of [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine?
[1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine has a molecular weight of 287.18 g/mol, XLogP of 3.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-3-fluorophenyl)-2-cyclobutylethyl]hydrazine is sourced from PubChem (CID 105310116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).