2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine

C14H20FN — CID 117271498

IUPAC2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine
SMILESCCC1(CCc2cccc(F)c2)CCCN1
InChIInChI=1S/C14H20FN/c1-2-14(8-4-10-16-14)9-7-12-5-3-6-13(15)11-12/h3,5-6,11,16H,2,4,7-10H2,1H3
InChIKeyFABPSSCNEKTXMW-UHFFFAOYSA-N
MW221.32 g/mol
LogP3.29
Rot. Bonds4

About 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine

2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine (PubChem CID 117271498) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine.

Molecular Properties

Compound Name2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine
PubChem CID117271498
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine
SMILESCCC1(CCc2cccc(F)c2)CCCN1
InChIInChI=1S/C14H20FN/c1-2-14(8-4-10-16-14)9-7-12-5-3-6-13(15)11-12/h3,5-6,11,16H,2,4,7-10H2,1H3
InChIKeyFABPSSCNEKTXMW-UHFFFAOYSA-N
XLogP3.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine 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

2-ethyl-2-[(3-fluorophenyl)methyl]azetidine
CID 115058779
2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine
CID 117271535
2-[(3-fluorophenyl)methyl]-2-(2-methylpropyl)pyrrolidine
CID 66467441
N-[(2-ethylpyrrolidin-2-yl)methyl]-3-fluoro-N-methylaniline
CID 83073883
2-[2-(4-bromophenyl)ethyl]-2-ethylpiperidine
CID 117271757
2-ethyl-2-(2-thiophen-2-ylethyl)pyrrolidine
CID 66467603
2-ethyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperidine
CID 117271747
N-ethyl-3-fluoro-N-[(2-propylpyrrolidin-2-yl)methyl]aniline
CID 106976356
2-[(3-fluorophenyl)methyl]-2-methyl-1,3-thiazinane
CID 114834360
2-ethyl-2-(2-thiophen-2-ylethyl)piperidine
CID 117271805
2-ethyl-2-[2-[2-(trifluoromethyl)phenyl]ethyl]piperidine
CID 117271726
2-ethyl-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]pyrrolidine
CID 104688287

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine?
The IUPAC name of 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine (CID 117271498) is 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine.
What is the SMILES notation for 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine?
The canonical SMILES for 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine is CCC1(CCc2cccc(F)c2)CCCN1.
What is the InChIKey of 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine?
The InChIKey is FABPSSCNEKTXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN/c1-2-14(8-4-10-16-14)9-7-12-5-3-6-13(15)11-12/h3,5-6,11,16H,2,4,7-10H2,1H3.
What are the key properties of 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine?
2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine has a molecular weight of 221.32 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine is sourced from PubChem (CID 117271498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).