[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine

C13H15F5N2 — CID 105299069

IUPAC[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
SMILESNNC(CC1CCCC1)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C13H15F5N2/c14-9-8(10(15)12(17)13(18)11(9)16)7(20-19)5-6-3-1-2-4-6/h6-7,20H,1-5,19H2
InChIKeyGDYXANJIOXKLCJ-UHFFFAOYSA-N
MW294.27 g/mol
LogP3.47
Rot. Bonds4

About [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine

[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine (PubChem CID 105299069) has the molecular formula C13H15F5N2 and a molecular weight of 294.27 g/mol. Its IUPAC name is [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
PubChem CID105299069
Molecular FormulaC13H15F5N2
Molecular Weight294.27 g/mol
Exact Mass294.12
IUPAC Name[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
SMILESNNC(CC1CCCC1)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C13H15F5N2/c14-9-8(10(15)12(17)13(18)11(9)16)7(20-19)5-6-3-1-2-4-6/h6-7,20H,1-5,19H2
InChIKeyGDYXANJIOXKLCJ-UHFFFAOYSA-N
XLogP3.47
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.27
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-cyclohexyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine
CID 105296186
[2-cycloheptyl-1-(2,6-difluorophenyl)ethyl]hydrazine
CID 105308040
[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105310002
[1-(3-bromo-2,6-difluorophenyl)-2-cyclobutylethyl]hydrazine
CID 106945539
[2-cyclopentyl-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105299116
[2-cycloheptyl-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105301798
[2-cyclobutyl-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207885
[1-(5-chloro-2-fluorophenyl)-2-cyclopentylethyl]hydrazine
CID 105280031
[2-cyclobutyl-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105310166
[1-(cyclohepten-1-yl)-2-cycloheptylethyl]hydrazine
CID 106650401
[2-cycloheptyl-1-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105329278
[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine
CID 105296167

Frequently Asked Questions

What is the IUPAC name of [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine (CID 105299069) is [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine is NNC(CC1CCCC1)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine?
The InChIKey is GDYXANJIOXKLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F5N2/c14-9-8(10(15)12(17)13(18)11(9)16)7(20-19)5-6-3-1-2-4-6/h6-7,20H,1-5,19H2.
What are the key properties of [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine?
[2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine has a molecular weight of 294.27 g/mol, XLogP of 3.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopentyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105299069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).