[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine

C13H16ClF3N2 — CID 114216989

IUPAC[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine
SMILESNNC(Cc1c(F)cccc1Cl)C1CCC(F)(F)C1
InChIInChI=1S/C13H16ClF3N2/c14-10-2-1-3-11(15)9(10)6-12(19-18)8-4-5-13(16,17)7-8/h1-3,8,12,19H,4-7,18H2
InChIKeyDGAZPWUPFCIBLQ-UHFFFAOYSA-N
MW292.73 g/mol
LogP3.29
Rot. Bonds4

About [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine

[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine (PubChem CID 114216989) has the molecular formula C13H16ClF3N2 and a molecular weight of 292.73 g/mol. Its IUPAC name is [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine
PubChem CID114216989
Molecular FormulaC13H16ClF3N2
Molecular Weight292.73 g/mol
Exact Mass292.10
IUPAC Name[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine
SMILESNNC(Cc1c(F)cccc1Cl)C1CCC(F)(F)C1
InChIInChI=1S/C13H16ClF3N2/c14-10-2-1-3-11(15)9(10)6-12(19-18)8-4-5-13(16,17)7-8/h1-3,8,12,19H,4-7,18H2
InChIKeyDGAZPWUPFCIBLQ-UHFFFAOYSA-N
XLogP3.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.73
LogP ≤ 53.29
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

[2-(2-chloro-6-fluorophenyl)-1-(5-methyloxolan-2-yl)ethyl]hydrazine
CID 105289102
[2-(2,6-dichlorophenyl)-1-(5-oxaspiro[3.5]nonan-8-yl)ethyl]hydrazine
CID 105209863
2-(2,6-dichlorophenyl)-1-(4,4-difluorocyclohexyl)-N-ethylethanamine
CID 105122810
[1-(3,3-difluorocyclopentyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 114216956
2-(2-chloro-6-fluorophenyl)-1-cyclopropylethanamine
CID 61078474
1-(2-chloro-6-fluorophenyl)-3-cyclopropylbutan-2-amine
CID 83153746
2-(2-chloro-6-fluorophenyl)-1-cyclopentyl-N-ethylethanamine
CID 61079872
[2-(2,6-dichlorophenyl)-1-(thiolan-3-yl)ethyl]hydrazine
CID 105293205
2-(2-chloro-6-fluorophenyl)-1-cyclohexyl-N-ethylethanamine
CID 63413792
1-chloro-2-(2-chloropropyl)-3-fluorobenzene
CID 63016068
2-(2-chloro-6-fluorophenyl)-1-(2,2-dimethylcyclopropyl)ethanamine
CID 107001824
[2-(3-chloro-2-fluorophenyl)-1-cyclopropylethyl]hydrazine
CID 105264277

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine (CID 114216989) is [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine is NNC(Cc1c(F)cccc1Cl)C1CCC(F)(F)C1.
What is the InChIKey of [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine?
The InChIKey is DGAZPWUPFCIBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClF3N2/c14-10-2-1-3-11(15)9(10)6-12(19-18)8-4-5-13(16,17)7-8/h1-3,8,12,19H,4-7,18H2.
What are the key properties of [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine?
[2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine has a molecular weight of 292.73 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-6-fluorophenyl)-1-(3,3-difluorocyclopentyl)ethyl]hydrazine is sourced from PubChem (CID 114216989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).