2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine

C15H24N2O — CID 79687732

IUPAC2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine
SMILESCCC1(CC)CN(c2ccccc2OCCN)C1
InChIInChI=1S/C15H24N2O/c1-3-15(4-2)11-17(12-15)13-7-5-6-8-14(13)18-10-9-16/h5-8H,3-4,9-12,16H2,1-2H3
InChIKeyXSPWUMCLUJWUSC-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.65
Rot. Bonds6

About 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine

2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine (PubChem CID 79687732) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine
PubChem CID79687732
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine
SMILESCCC1(CC)CN(c2ccccc2OCCN)C1
InChIInChI=1S/C15H24N2O/c1-3-15(4-2)11-17(12-15)13-7-5-6-8-14(13)18-10-9-16/h5-8H,3-4,9-12,16H2,1-2H3
InChIKeyXSPWUMCLUJWUSC-UHFFFAOYSA-N
XLogP2.65
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine 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-[3-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine
CID 79677781
1-(2-butoxyphenyl)pyrrolidine
CID 154391189
2-[2-(2-aminoethoxy)phenoxy]ethanamine
CID 2054448
3-[2-(2-aminoethoxy)phenyl]imidazolidine-2,4-dione
CID 114007840
1-[2-(3,3-diethylazetidin-1-yl)phenyl]-N-methylethanamine
CID 79678198
2-[1-(2-ethoxyphenyl)piperidin-3-yl]ethanamine
CID 117002698
1-[2-(3-fluoropropoxy)phenyl]piperidin-3-amine
CID 81113423
4-[4-[2-(2-fluoroethoxy)phenyl]piperazin-1-yl]butan-1-amine
CID 51357649
1-(2-octoxyphenyl)piperazine
CID 63461603
1-[2-(3-ethoxypropoxy)phenyl]-1,4-diazepane
CID 65181009
2-(7-butoxy-3,3-diethyl-4-fluoro-2H-indol-1-yl)aniline
CID 118375139
1-[2-[3-(dimethylamino)propoxy]phenyl]piperidin-4-amine
CID 114526497

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine?
The IUPAC name of 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine (CID 79687732) is 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine.
What is the SMILES notation for 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine?
The canonical SMILES for 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine is CCC1(CC)CN(c2ccccc2OCCN)C1.
What is the InChIKey of 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine?
The InChIKey is XSPWUMCLUJWUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-15(4-2)11-17(12-15)13-7-5-6-8-14(13)18-10-9-16/h5-8H,3-4,9-12,16H2,1-2H3.
What are the key properties of 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine?
2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,3-diethylazetidin-1-yl)phenoxy]ethanamine is sourced from PubChem (CID 79687732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).