1-[2-(2-fluoroethoxy)ethyl]piperazine

C8H17FN2O — CID 22281469

IUPAC1-[2-(2-fluoroethoxy)ethyl]piperazine
SMILESFCCOCCN1CCNCC1
InChIInChI=1S/C8H17FN2O/c9-1-7-12-8-6-11-4-2-10-3-5-11/h10H,1-8H2
InChIKeySXEKIIWNHOYIPV-UHFFFAOYSA-N
MW176.23 g/mol
LogP-0.12
Rot. Bonds5

About 1-[2-(2-fluoroethoxy)ethyl]piperazine

1-[2-(2-fluoroethoxy)ethyl]piperazine (PubChem CID 22281469) has the molecular formula C8H17FN2O and a molecular weight of 176.23 g/mol. Its IUPAC name is 1-[2-(2-fluoroethoxy)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-fluoroethoxy)ethyl]piperazine
PubChem CID22281469
Molecular FormulaC8H17FN2O
Molecular Weight176.23 g/mol
Exact Mass176.13
IUPAC Name1-[2-(2-fluoroethoxy)ethyl]piperazine
SMILESFCCOCCN1CCNCC1
InChIInChI=1S/C8H17FN2O/c9-1-7-12-8-6-11-4-2-10-3-5-11/h10H,1-8H2
InChIKeySXEKIIWNHOYIPV-UHFFFAOYSA-N
XLogP-0.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.23
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluoroethoxy)ethyl]piperazine?
The IUPAC name of 1-[2-(2-fluoroethoxy)ethyl]piperazine (CID 22281469) is 1-[2-(2-fluoroethoxy)ethyl]piperazine.
What is the SMILES notation for 1-[2-(2-fluoroethoxy)ethyl]piperazine?
The canonical SMILES for 1-[2-(2-fluoroethoxy)ethyl]piperazine is FCCOCCN1CCNCC1.
What is the InChIKey of 1-[2-(2-fluoroethoxy)ethyl]piperazine?
The InChIKey is SXEKIIWNHOYIPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2O/c9-1-7-12-8-6-11-4-2-10-3-5-11/h10H,1-8H2.
What are the key properties of 1-[2-(2-fluoroethoxy)ethyl]piperazine?
1-[2-(2-fluoroethoxy)ethyl]piperazine has a molecular weight of 176.23 g/mol, XLogP of -0.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluoroethoxy)ethyl]piperazine is sourced from PubChem (CID 22281469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).