3-(4-fluorophenyl)pyrazolidine

C9H11FN2 — CID 105433016

IUPAC3-(4-fluorophenyl)pyrazolidine
SMILESFc1ccc(C2CCNN2)cc1
InChIInChI=1S/C9H11FN2/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-4,9,11-12H,5-6H2
InChIKeyKDQFHXZWNMYCFJ-UHFFFAOYSA-N
MW166.20 g/mol
LogP1.36
Rot. Bonds1

About 3-(4-fluorophenyl)pyrazolidine

3-(4-fluorophenyl)pyrazolidine (PubChem CID 105433016) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is 3-(4-fluorophenyl)pyrazolidine.

Molecular Properties

Compound Name3-(4-fluorophenyl)pyrazolidine
PubChem CID105433016
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name3-(4-fluorophenyl)pyrazolidine
SMILESFc1ccc(C2CCNN2)cc1
InChIInChI=1S/C9H11FN2/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-4,9,11-12H,5-6H2
InChIKeyKDQFHXZWNMYCFJ-UHFFFAOYSA-N
XLogP1.36
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)pyrazolidine?
The IUPAC name of 3-(4-fluorophenyl)pyrazolidine (CID 105433016) is 3-(4-fluorophenyl)pyrazolidine.
What is the SMILES notation for 3-(4-fluorophenyl)pyrazolidine?
The canonical SMILES for 3-(4-fluorophenyl)pyrazolidine is Fc1ccc(C2CCNN2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)pyrazolidine?
The InChIKey is KDQFHXZWNMYCFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2/c10-8-3-1-7(2-4-8)9-5-6-11-12-9/h1-4,9,11-12H,5-6H2.
What are the key properties of 3-(4-fluorophenyl)pyrazolidine?
3-(4-fluorophenyl)pyrazolidine has a molecular weight of 166.20 g/mol, XLogP of 1.36, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)pyrazolidine is sourced from PubChem (CID 105433016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).