1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine

C15H23NO3 — CID 102606061

IUPAC1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine
SMILESCCNC(COC1COC1)c1ccc(OCC)cc1
InChIInChI=1S/C15H23NO3/c1-3-16-15(11-19-14-9-17-10-14)12-5-7-13(8-6-12)18-4-2/h5-8,14-16H,3-4,9-11H2,1-2H3
InChIKeyRWIDWLWJFFRBGR-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.15
Rot. Bonds8

About 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine

1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine (PubChem CID 102606061) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine
PubChem CID102606061
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine
SMILESCCNC(COC1COC1)c1ccc(OCC)cc1
InChIInChI=1S/C15H23NO3/c1-3-16-15(11-19-14-9-17-10-14)12-5-7-13(8-6-12)18-4-2/h5-8,14-16H,3-4,9-11H2,1-2H3
InChIKeyRWIDWLWJFFRBGR-UHFFFAOYSA-N
XLogP2.15
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethoxyphenyl)-2-(oxetan-3-yloxy)ethanol
CID 102607343
N-ethyl-1-(4-methoxyphenyl)-2-(oxolan-3-yloxy)ethanamine
CID 63557627
N-ethyl-1-(2-fluorophenyl)-2-(oxetan-3-yloxy)ethanamine
CID 114058381
N-methyl-2-(oxetan-3-yloxy)-1-(4-propylphenyl)ethanamine
CID 102605871
1-(4-ethoxyphenyl)-N-ethyl-4-methylpentan-1-amine
CID 43489419
1-(4-ethoxyphenyl)-N-ethyl-2-(oxan-4-ylsulfanyl)ethanamine
CID 64625568
N-ethyl-2-(oxetan-3-yloxy)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 102606046
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-2-(oxolan-3-yloxy)ethanamine
CID 63558021
N-ethyl-1-(2-methoxy-5-methylphenyl)-2-(oxetan-3-yloxy)ethanamine
CID 102606127
2-cyclopentylsulfanyl-1-(4-ethoxyphenyl)-N-ethylethanamine
CID 64628346
N-methyl-1-[4-(2-methylpropyl)phenyl]-2-(oxetan-3-yloxy)ethanamine
CID 102606147
2-cyclohexylsulfanyl-1-(4-ethoxyphenyl)-N-ethylethanamine
CID 64632442

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine?
The IUPAC name of 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine (CID 102606061) is 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine.
What is the SMILES notation for 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine?
The canonical SMILES for 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine is CCNC(COC1COC1)c1ccc(OCC)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine?
The InChIKey is RWIDWLWJFFRBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-3-16-15(11-19-14-9-17-10-14)12-5-7-13(8-6-12)18-4-2/h5-8,14-16H,3-4,9-11H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine?
1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine has a molecular weight of 265.35 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine is sourced from PubChem (CID 102606061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).