1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine

C14H21NO2 — CID 803619

IUPAC1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
SMILESCCOc1ccc(OCCN2CCCC2)cc1
InChIInChI=1S/C14H21NO2/c1-2-16-13-5-7-14(8-6-13)17-12-11-15-9-3-4-10-15/h5-8H,2-4,9-12H2,1H3
InChIKeyNXILRPFMBXHOCD-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.56
Rot. Bonds6

About 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine

1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine (PubChem CID 803619) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine.

Molecular Properties

Compound Name1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
PubChem CID803619
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
SMILESCCOc1ccc(OCCN2CCCC2)cc1
InChIInChI=1S/C14H21NO2/c1-2-16-13-5-7-14(8-6-13)17-12-11-15-9-3-4-10-15/h5-8H,2-4,9-12H2,1H3
InChIKeyNXILRPFMBXHOCD-UHFFFAOYSA-N
XLogP2.56
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-ethoxyphenoxy)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

1-[2-(4-ethoxyphenoxy)ethyl]-1,4-diazepane
CID 43162465
1-[2-(4-propoxyphenoxy)ethyl]piperidine;hydrochloride
CID 3030633
1-[2-(4-ethylphenoxy)ethyl]piperidine
CID 867198
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
1-[2-(4-propylphenoxy)ethyl]pyrrolidine
CID 54244276
3-ethoxy-5-(2-pyrrolidin-1-ylethoxy)aniline
CID 80748537
1-[4-[2-(4-ethoxyphenoxy)ethyl]piperazin-1-yl]ethanone
CID 78789869
1-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]piperidine
CID 70865812
(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-ol
CID 78933445
(1S)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-amine
CID 78937096
[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 10751471
1-[(4-ethoxyphenyl)methyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazine
CID 141313696

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine?
The IUPAC name of 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine (CID 803619) is 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine.
What is the SMILES notation for 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine?
The canonical SMILES for 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine is CCOc1ccc(OCCN2CCCC2)cc1.
What is the InChIKey of 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine?
The InChIKey is NXILRPFMBXHOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-16-13-5-7-14(8-6-13)17-12-11-15-9-3-4-10-15/h5-8H,2-4,9-12H2,1H3.
What are the key properties of 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine?
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine has a molecular weight of 235.33 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine is sourced from PubChem (CID 803619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).