[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine

C16H25FN2O — CID 105278882

IUPAC[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine
SMILESCCOC(C1CCCCC1)C(NN)c1cccc(F)c1
InChIInChI=1S/C16H25FN2O/c1-2-20-16(12-7-4-3-5-8-12)15(19-18)13-9-6-10-14(17)11-13/h6,9-12,15-16,19H,2-5,7-8,18H2,1H3
InChIKeyHWJNWPCECPDMDG-UHFFFAOYSA-N
MW280.39 g/mol
LogP3.32
Rot. Bonds6

About [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine

[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine (PubChem CID 105278882) has the molecular formula C16H25FN2O and a molecular weight of 280.39 g/mol. Its IUPAC name is [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine
PubChem CID105278882
Molecular FormulaC16H25FN2O
Molecular Weight280.39 g/mol
Exact Mass280.20
IUPAC Name[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine
SMILESCCOC(C1CCCCC1)C(NN)c1cccc(F)c1
InChIInChI=1S/C16H25FN2O/c1-2-20-16(12-7-4-3-5-8-12)15(19-18)13-9-6-10-14(17)11-13/h6,9-12,15-16,19H,2-5,7-8,18H2,1H3
InChIKeyHWJNWPCECPDMDG-UHFFFAOYSA-N
XLogP3.32
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine (CID 105278882) is [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine is CCOC(C1CCCCC1)C(NN)c1cccc(F)c1.
What is the InChIKey of [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine?
The InChIKey is HWJNWPCECPDMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2O/c1-2-20-16(12-7-4-3-5-8-12)15(19-18)13-9-6-10-14(17)11-13/h6,9-12,15-16,19H,2-5,7-8,18H2,1H3.
What are the key properties of [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine?
[2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine has a molecular weight of 280.39 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclohexyl-2-ethoxy-1-(3-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105278882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).