1-(4-fluorophenyl)pyrrolidine

C10H12FN — CID 15372180

IUPAC1-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc(N2CCCC2)cc1
InChIInChI=1S/C10H12FN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2
InChIKeyIIYRJYZDFOBAKW-UHFFFAOYSA-N
MW165.21 g/mol
LogP2.43
Rot. Bonds1

About 1-(4-fluorophenyl)pyrrolidine

1-(4-fluorophenyl)pyrrolidine (PubChem CID 15372180) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is 1-(4-fluorophenyl)pyrrolidine.

Molecular Properties

Compound Name1-(4-fluorophenyl)pyrrolidine
PubChem CID15372180
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name1-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc(N2CCCC2)cc1
InChIInChI=1S/C10H12FN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2
InChIKeyIIYRJYZDFOBAKW-UHFFFAOYSA-N
XLogP2.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)pyrrolidine?
The IUPAC name of 1-(4-fluorophenyl)pyrrolidine (CID 15372180) is 1-(4-fluorophenyl)pyrrolidine.
What is the SMILES notation for 1-(4-fluorophenyl)pyrrolidine?
The canonical SMILES for 1-(4-fluorophenyl)pyrrolidine is Fc1ccc(N2CCCC2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)pyrrolidine?
The InChIKey is IIYRJYZDFOBAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN/c11-9-3-5-10(6-4-9)12-7-1-2-8-12/h3-6H,1-2,7-8H2.
What are the key properties of 1-(4-fluorophenyl)pyrrolidine?
1-(4-fluorophenyl)pyrrolidine has a molecular weight of 165.21 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)pyrrolidine is sourced from PubChem (CID 15372180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).