[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine

C17H27FN2O — CID 105255092

IUPAC[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(CC(NN)C2CCCCCCC2)cc1F
InChIInChI=1S/C17H27FN2O/c1-21-17-10-9-13(11-15(17)18)12-16(20-19)14-7-5-3-2-4-6-8-14/h9-11,14,16,20H,2-8,12,19H2,1H3
InChIKeyQDZWKSPTCWOAFY-UHFFFAOYSA-N
MW294.41 g/mol
LogP3.57
Rot. Bonds5

About [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine

[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine (PubChem CID 105255092) has the molecular formula C17H27FN2O and a molecular weight of 294.41 g/mol. Its IUPAC name is [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
PubChem CID105255092
Molecular FormulaC17H27FN2O
Molecular Weight294.41 g/mol
Exact Mass294.21
IUPAC Name[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
SMILESCOc1ccc(CC(NN)C2CCCCCCC2)cc1F
InChIInChI=1S/C17H27FN2O/c1-21-17-10-9-13(11-15(17)18)12-16(20-19)14-7-5-3-2-4-6-8-14/h9-11,14,16,20H,2-8,12,19H2,1H3
InChIKeyQDZWKSPTCWOAFY-UHFFFAOYSA-N
XLogP3.57
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.41
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-cyclohexyl-2-(3,4-difluorophenyl)ethyl]hydrazine
CID 105201895
[1-cycloheptyl-3-(3-fluoro-4-methoxyphenyl)propan-2-yl]hydrazine
CID 105292967
1-cycloheptyl-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 65398856
1-cycloheptyl-2-(3-fluoro-4-methoxyphenyl)ethanol
CID 65399384
[2-(3-bromo-4-methoxyphenyl)-1-cyclopropylethyl]hydrazine
CID 105202342
1-(6-bicyclo[3.1.0]hexanyl)-2-(3-fluoro-4-methoxyphenyl)-N-methylethanamine
CID 115829530
1-cyclobutyl-3-(3-fluoro-4-methoxyphenyl)propan-2-amine
CID 103168395
[1-cyclooctyl-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105255263
4-cyclopentyl-1-(3-fluoro-4-methoxyphenyl)butan-2-amine
CID 115829847
4-cyclohexyl-1-(3-fluoro-4-methoxyphenyl)-N-methylbutan-2-amine
CID 115829566
[1-cyclohexyl-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250515
[1-cyclopentyl-2-(4-methylphenyl)ethyl]hydrazine
CID 105204429

Frequently Asked Questions

What is the IUPAC name of [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine?
The IUPAC name of [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine (CID 105255092) is [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine is COc1ccc(CC(NN)C2CCCCCCC2)cc1F.
What is the InChIKey of [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine?
The InChIKey is QDZWKSPTCWOAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27FN2O/c1-21-17-10-9-13(11-15(17)18)12-16(20-19)14-7-5-3-2-4-6-8-14/h9-11,14,16,20H,2-8,12,19H2,1H3.
What are the key properties of [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine?
[1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine has a molecular weight of 294.41 g/mol, XLogP of 3.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclooctyl-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105255092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).