[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine

C11H13ClF4N2 — CID 107997242

IUPAC[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine
SMILESNNC(CCCC(F)(F)F)c1ccc(Cl)c(F)c1
InChIInChI=1S/C11H13ClF4N2/c12-8-4-3-7(6-9(8)13)10(18-17)2-1-5-11(14,15)16/h3-4,6,10,18H,1-2,5,17H2
InChIKeyVUQXAHXHJDMVHI-UHFFFAOYSA-N
MW284.68 g/mol
LogP3.72
Rot. Bonds5

About [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine

[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine (PubChem CID 107997242) has the molecular formula C11H13ClF4N2 and a molecular weight of 284.68 g/mol. Its IUPAC name is [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine
PubChem CID107997242
Molecular FormulaC11H13ClF4N2
Molecular Weight284.68 g/mol
Exact Mass284.07
IUPAC Name[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine
SMILESNNC(CCCC(F)(F)F)c1ccc(Cl)c(F)c1
InChIInChI=1S/C11H13ClF4N2/c12-8-4-3-7(6-9(8)13)10(18-17)2-1-5-11(14,15)16/h3-4,6,10,18H,1-2,5,17H2
InChIKeyVUQXAHXHJDMVHI-UHFFFAOYSA-N
XLogP3.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.68
LogP ≤ 53.72
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

[5,5,5-trifluoro-1-[4-fluoro-3-(trifluoromethyl)phenyl]pentyl]hydrazine
CID 105328962
[1-(2-chloro-4-pyridinyl)-5,5,5-trifluoropentyl]hydrazine
CID 105252699
[1-(3-chloro-4-methylphenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313900
1-(3-chloro-4-fluorophenyl)-5,5,5-trifluoro-N-methylpentan-1-amine
CID 115516717
1-(4-chloro-3-fluorophenyl)but-3-enylhydrazine
CID 107996762
[4,4,4-trifluoro-1-(4-propan-2-ylphenyl)butyl]hydrazine
CID 105193990
N,N-dimethyl-4-(5,5,5-trifluoro-1-hydrazinylpentyl)aniline
CID 105328860
[1-(4-chloro-3-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 107997063
[1-(3-chloro-4-fluorophenyl)-4,4-dimethylpentyl]hydrazine
CID 105218176
[1-(2,6-dichlorophenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313893
[1-(2,3-dihydro-1-benzofuran-5-yl)-5,5,5-trifluoropentyl]hydrazine
CID 105328955
(5,5,5-trifluoro-1-thiophen-3-ylpentyl)hydrazine
CID 105196769

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine?
The IUPAC name of [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine (CID 107997242) is [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine?
The canonical SMILES for [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine is NNC(CCCC(F)(F)F)c1ccc(Cl)c(F)c1.
What is the InChIKey of [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine?
The InChIKey is VUQXAHXHJDMVHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClF4N2/c12-8-4-3-7(6-9(8)13)10(18-17)2-1-5-11(14,15)16/h3-4,6,10,18H,1-2,5,17H2.
What are the key properties of [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine?
[1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine has a molecular weight of 284.68 g/mol, XLogP of 3.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-3-fluorophenyl)-5,5,5-trifluoropentyl]hydrazine is sourced from PubChem (CID 107997242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).