1-(2,6-difluoro-3-methylphenyl)hexylhydrazine

C13H20F2N2 — CID 105294572

IUPAC1-(2,6-difluoro-3-methylphenyl)hexylhydrazine
SMILESCCCCCC(NN)c1c(F)ccc(C)c1F
InChIInChI=1S/C13H20F2N2/c1-3-4-5-6-11(17-16)12-10(14)8-7-9(2)13(12)15/h7-8,11,17H,3-6,16H2,1-2H3
InChIKeyMZVVXYQDFKHZJB-UHFFFAOYSA-N
MW242.31 g/mol
LogP3.36
Rot. Bonds6

About 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine

1-(2,6-difluoro-3-methylphenyl)hexylhydrazine (PubChem CID 105294572) has the molecular formula C13H20F2N2 and a molecular weight of 242.31 g/mol. Its IUPAC name is 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine.

Molecular Properties

Compound Name1-(2,6-difluoro-3-methylphenyl)hexylhydrazine
PubChem CID105294572
Molecular FormulaC13H20F2N2
Molecular Weight242.31 g/mol
Exact Mass242.16
IUPAC Name1-(2,6-difluoro-3-methylphenyl)hexylhydrazine
SMILESCCCCCC(NN)c1c(F)ccc(C)c1F
InChIInChI=1S/C13H20F2N2/c1-3-4-5-6-11(17-16)12-10(14)8-7-9(2)13(12)15/h7-8,11,17H,3-6,16H2,1-2H3
InChIKeyMZVVXYQDFKHZJB-UHFFFAOYSA-N
XLogP3.36
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2,6-difluoro-3-methylphenyl)-N-methylheptan-1-amine
CID 115833762
[1-(2,6-difluoro-3-methylphenyl)-3-ethylheptyl]hydrazine
CID 105288270
3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259156
1-(2,6-difluoro-3-methylphenyl)hexan-1-amine
CID 115837632
(1S)-1-(2,6-difluoro-3-methylphenyl)hexan-1-amine;hydrochloride
CID 171229559
1-(4-fluoro-3-methylphenyl)hexylhydrazine
CID 105204173
1-(2-fluoro-4,6-dimethylphenyl)heptylhydrazine
CID 106884598
1-(4-fluoro-3-methylphenyl)undecylhydrazine
CID 105204213
1-(2-fluoro-3-methylphenyl)undecylhydrazine
CID 105298411
1-(2-fluoro-3-methylphenyl)octylhydrazine
CID 105293647
1-(2,6-difluoro-3-methylphenyl)-N-ethylbutan-1-amine
CID 82823122
1-(2,3-difluorophenyl)hexylhydrazine
CID 105294688

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine?
The IUPAC name of 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine (CID 105294572) is 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine.
What is the SMILES notation for 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine?
The canonical SMILES for 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine is CCCCCC(NN)c1c(F)ccc(C)c1F.
What is the InChIKey of 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine?
The InChIKey is MZVVXYQDFKHZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2N2/c1-3-4-5-6-11(17-16)12-10(14)8-7-9(2)13(12)15/h7-8,11,17H,3-6,16H2,1-2H3.
What are the key properties of 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine?
1-(2,6-difluoro-3-methylphenyl)hexylhydrazine has a molecular weight of 242.31 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluoro-3-methylphenyl)hexylhydrazine is sourced from PubChem (CID 105294572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).