[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine

C11H14F4N2 — CID 105249105

IUPAC[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine
SMILESCc1cc(F)cc(C(CCC(F)(F)F)NN)c1
InChIInChI=1S/C11H14F4N2/c1-7-4-8(6-9(12)5-7)10(17-16)2-3-11(13,14)15/h4-6,10,17H,2-3,16H2,1H3
InChIKeyRLZUGZALYKEORF-UHFFFAOYSA-N
MW250.24 g/mol
LogP2.98
Rot. Bonds4

About [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine

[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine (PubChem CID 105249105) has the molecular formula C11H14F4N2 and a molecular weight of 250.24 g/mol. Its IUPAC name is [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine
PubChem CID105249105
Molecular FormulaC11H14F4N2
Molecular Weight250.24 g/mol
Exact Mass250.11
IUPAC Name[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine
SMILESCc1cc(F)cc(C(CCC(F)(F)F)NN)c1
InChIInChI=1S/C11H14F4N2/c1-7-4-8(6-9(12)5-7)10(17-16)2-3-11(13,14)15/h4-6,10,17H,2-3,16H2,1H3
InChIKeyRLZUGZALYKEORF-UHFFFAOYSA-N
XLogP2.98
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 52.98
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

[3-cyclopentyl-1-(3-fluoro-5-methylphenyl)propyl]hydrazine
CID 105325325
[1-(3-fluoro-5-methylphenyl)-3-methylsulfonylpropyl]hydrazine
CID 114984862
[3-ethoxy-1-(3-fluoro-5-methylphenyl)propyl]hydrazine
CID 105325359
[4,4,4-trifluoro-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105313895
[4,4,4-trifluoro-1-(3,4,5-trimethoxyphenyl)butyl]hydrazine
CID 105313821
[1-(3-chloro-4-methylphenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313900
[4,4,4-trifluoro-1-(4-propan-2-ylphenyl)butyl]hydrazine
CID 105193990
[1-(3,5-difluorophenyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
CID 103217435
1-(3,5-dimethylphenyl)-4,4,4-trifluoro-N-propylbutan-1-amine
CID 79954110
[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine
CID 105257527
1-(3,5-difluorophenyl)hexylhydrazine
CID 105207948
1-(3,5-difluorophenyl)propylhydrazine
CID 53402270

Frequently Asked Questions

What is the IUPAC name of [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine?
The IUPAC name of [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine (CID 105249105) is [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine.
What is the SMILES notation for [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine?
The canonical SMILES for [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine is Cc1cc(F)cc(C(CCC(F)(F)F)NN)c1.
What is the InChIKey of [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine?
The InChIKey is RLZUGZALYKEORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F4N2/c1-7-4-8(6-9(12)5-7)10(17-16)2-3-11(13,14)15/h4-6,10,17H,2-3,16H2,1H3.
What are the key properties of [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine?
[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine has a molecular weight of 250.24 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine is sourced from PubChem (CID 105249105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).