2-(4-fluorophenyl)-1-propylpyrrolidine

C13H18FN — CID 102544448

IUPAC2-(4-fluorophenyl)-1-propylpyrrolidine
SMILESCCCN1CCCC1c1ccc(F)cc1
InChIInChI=1S/C13H18FN/c1-2-9-15-10-3-4-13(15)11-5-7-12(14)8-6-11/h5-8,13H,2-4,9-10H2,1H3
InChIKeyKUNBWLQYGXEWOE-UHFFFAOYSA-N
MW207.29 g/mol
LogP3.37
Rot. Bonds3

About 2-(4-fluorophenyl)-1-propylpyrrolidine

2-(4-fluorophenyl)-1-propylpyrrolidine (PubChem CID 102544448) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-propylpyrrolidine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-propylpyrrolidine
PubChem CID102544448
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name2-(4-fluorophenyl)-1-propylpyrrolidine
SMILESCCCN1CCCC1c1ccc(F)cc1
InChIInChI=1S/C13H18FN/c1-2-9-15-10-3-4-13(15)11-5-7-12(14)8-6-11/h5-8,13H,2-4,9-10H2,1H3
InChIKeyKUNBWLQYGXEWOE-UHFFFAOYSA-N
XLogP3.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(4-fluorophenyl)-1-propylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(4-fluorophenyl)-1-(2-methoxyethyl)pyrrolidine
CID 94616401
2-[2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]ethoxy]ethanol
CID 95719841
(2S)-2-(4-fluorophenyl)-1-(3-methoxypropyl)piperidine
CID 95727213
2-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-methylacetamide
CID 47019472
2-(4-fluorophenyl)-1-[(4-propoxyphenyl)methyl]pyrrolidine
CID 20895915
2-(4-fluorophenyl)-1-(2-methylpropyl)azepane
CID 90816221
3-[3-[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]propyl]imidazolidine-2,4-dione
CID 95048524
3-[(2S)-2-(4-fluorophenyl)piperidin-1-yl]propanamide
CID 95715360
5-[[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-3-propyl-1,2,4-oxadiazole
CID 134038787
3-ethyl-5-[[(2R)-2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-1H-1,2,4-triazole
CID 124756604
3-[(2S)-2-(4-fluorophenyl)piperidin-1-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 95894518
(2R)-2-(furan-3-yl)-1-propylpiperidine
CID 124500902

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-propylpyrrolidine?
The IUPAC name of 2-(4-fluorophenyl)-1-propylpyrrolidine (CID 102544448) is 2-(4-fluorophenyl)-1-propylpyrrolidine.
What is the SMILES notation for 2-(4-fluorophenyl)-1-propylpyrrolidine?
The canonical SMILES for 2-(4-fluorophenyl)-1-propylpyrrolidine is CCCN1CCCC1c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-1-propylpyrrolidine?
The InChIKey is KUNBWLQYGXEWOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-2-9-15-10-3-4-13(15)11-5-7-12(14)8-6-11/h5-8,13H,2-4,9-10H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-propylpyrrolidine?
2-(4-fluorophenyl)-1-propylpyrrolidine has a molecular weight of 207.29 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-propylpyrrolidine is sourced from PubChem (CID 102544448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).