[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine

C16H24F2N2 — CID 107516472

IUPAC[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)C2CCCCCCC2)c(F)c1F
InChIInChI=1S/C16H24F2N2/c1-11-9-10-13(15(18)14(11)17)16(20-19)12-7-5-3-2-4-6-8-12/h9-10,12,16,20H,2-8,19H2,1H3
InChIKeyIIMWVJATVLUBQN-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.14
Rot. Bonds3

About [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine

[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine (PubChem CID 107516472) has the molecular formula C16H24F2N2 and a molecular weight of 282.38 g/mol. Its IUPAC name is [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
PubChem CID107516472
Molecular FormulaC16H24F2N2
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)C2CCCCCCC2)c(F)c1F
InChIInChI=1S/C16H24F2N2/c1-11-9-10-13(15(18)14(11)17)16(20-19)12-7-5-3-2-4-6-8-12/h9-10,12,16,20H,2-8,19H2,1H3
InChIKeyIIMWVJATVLUBQN-UHFFFAOYSA-N
XLogP4.14
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.14
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

[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine
CID 105231971
[cyclohexyl-(2,5-dimethylphenyl)methyl]hydrazine
CID 105201807
[cyclooctyl-(2-methylphenyl)methyl]hydrazine
CID 105254975
[cycloheptyl-(2-methoxy-3,4-dimethylphenyl)methyl]hydrazine
CID 103435988
2-cyclohexyl-1-(2,3-difluoro-4-methylphenyl)ethanamine
CID 107515963
[(2,3-difluoro-4-methylphenyl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 107516568
[(4-chloro-2-fluorophenyl)-cycloheptylmethyl]hydrazine
CID 105217855
[(2,3-difluoro-4-methylphenyl)-(3-methyloxolan-2-yl)methyl]hydrazine
CID 107516672
[cyclooctyl-(2,5-difluorophenyl)methyl]hydrazine
CID 105255093
[(2-fluoro-3-methylphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105313617
[(2,3-difluoro-4-methylphenyl)-(2,3-dihydro-1H-inden-1-yl)methyl]hydrazine
CID 107516416
[(2,3-difluoro-4-methylphenyl)-(7-oxabicyclo[2.2.1]heptan-2-yl)methyl]hydrazine
CID 107516382

Frequently Asked Questions

What is the IUPAC name of [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine?
The IUPAC name of [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine (CID 107516472) is [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine?
The canonical SMILES for [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine is Cc1ccc(C(NN)C2CCCCCCC2)c(F)c1F.
What is the InChIKey of [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine?
The InChIKey is IIMWVJATVLUBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24F2N2/c1-11-9-10-13(15(18)14(11)17)16(20-19)12-7-5-3-2-4-6-8-12/h9-10,12,16,20H,2-8,19H2,1H3.
What are the key properties of [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine?
[cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine has a molecular weight of 282.38 g/mol, XLogP of 4.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclooctyl-(2,3-difluoro-4-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 107516472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).