[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine

C16H24BrFN2 — CID 105255038

IUPAC[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)C1CCCCCCC1
InChIInChI=1S/C16H24BrFN2/c17-16-13(9-6-10-14(16)18)11-15(20-19)12-7-4-2-1-3-5-8-12/h6,9-10,12,15,20H,1-5,7-8,11,19H2
InChIKeyZOOXKOOTDFJABK-UHFFFAOYSA-N
MW343.28 g/mol
LogP4.32
Rot. Bonds4

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

[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine (PubChem CID 105255038) has the molecular formula C16H24BrFN2 and a molecular weight of 343.28 g/mol. Its IUPAC name is [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine
PubChem CID105255038
Molecular FormulaC16H24BrFN2
Molecular Weight343.28 g/mol
Exact Mass342.11
IUPAC Name[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Br)C1CCCCCCC1
InChIInChI=1S/C16H24BrFN2/c17-16-13(9-6-10-14(16)18)11-15(20-19)12-7-4-2-1-3-5-8-12/h6,9-10,12,15,20H,1-5,7-8,11,19H2
InChIKeyZOOXKOOTDFJABK-UHFFFAOYSA-N
XLogP4.32
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.28
LogP ≤ 54.32
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-(2-bromo-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethyl]hydrazine
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[2-(2-bromo-3-fluorophenyl)-1-(thian-2-yl)ethyl]hydrazine
CID 105255720
[2-(2-bromophenyl)-1-cyclohexylethyl]hydrazine
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[2-(2-bromo-3-fluorophenyl)-1-(oxolan-2-yl)ethyl]hydrazine
CID 105228977
[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine
CID 105264361
1-(2-bromo-3-fluorophenyl)-3-cyclohexyl-N-ethylpropan-2-amine
CID 105020439
[1-cyclooctyl-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105255263
(1-cyclohexyl-2-naphthalen-1-ylethyl)hydrazine
CID 105201891
1-(2-bromo-3-fluorophenyl)-3-cyclopentyl-N-ethylpropan-2-amine
CID 105020430
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
CID 105234372
1-(2-bromo-3-fluorophenyl)-3-cyclopropylbutan-2-amine
CID 105020612
[1-(2-bromo-3-fluorophenyl)-3-cyclopentylsulfanylpropan-2-yl]hydrazine
CID 105227417

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine?
The IUPAC name of [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine (CID 105255038) is [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine is NNC(Cc1cccc(F)c1Br)C1CCCCCCC1.
What is the InChIKey of [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine?
The InChIKey is ZOOXKOOTDFJABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24BrFN2/c17-16-13(9-6-10-14(16)18)11-15(20-19)12-7-4-2-1-3-5-8-12/h6,9-10,12,15,20H,1-5,7-8,11,19H2.
What are the key properties of [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine?
[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine has a molecular weight of 343.28 g/mol, XLogP of 4.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine is sourced from PubChem (CID 105255038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).