2-(4-fluorophenyl)azetidine

C9H10FN — CID 42647381

IUPAC2-(4-fluorophenyl)azetidine
SMILESFc1ccc(C2CCN2)cc1
InChIInChI=1S/C9H10FN/c10-8-3-1-7(2-4-8)9-5-6-11-9/h1-4,9,11H,5-6H2
InChIKeyLWSFAJGOENYINQ-UHFFFAOYSA-N
MW151.18 g/mol
LogP1.86
Rot. Bonds1

About 2-(4-fluorophenyl)azetidine

2-(4-fluorophenyl)azetidine (PubChem CID 42647381) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is 2-(4-fluorophenyl)azetidine.

Molecular Properties

Compound Name2-(4-fluorophenyl)azetidine
PubChem CID42647381
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name2-(4-fluorophenyl)azetidine
SMILESFc1ccc(C2CCN2)cc1
InChIInChI=1S/C9H10FN/c10-8-3-1-7(2-4-8)9-5-6-11-9/h1-4,9,11H,5-6H2
InChIKeyLWSFAJGOENYINQ-UHFFFAOYSA-N
XLogP1.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)azetidine?
The IUPAC name of 2-(4-fluorophenyl)azetidine (CID 42647381) is 2-(4-fluorophenyl)azetidine.
What is the SMILES notation for 2-(4-fluorophenyl)azetidine?
The canonical SMILES for 2-(4-fluorophenyl)azetidine is Fc1ccc(C2CCN2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)azetidine?
The InChIKey is LWSFAJGOENYINQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c10-8-3-1-7(2-4-8)9-5-6-11-9/h1-4,9,11H,5-6H2.
What are the key properties of 2-(4-fluorophenyl)azetidine?
2-(4-fluorophenyl)azetidine has a molecular weight of 151.18 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)azetidine is sourced from PubChem (CID 42647381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).