1-[2-(oxetan-3-yloxy)phenyl]ethanamine

C11H15NO2 — CID 83484227

IUPAC1-[2-(oxetan-3-yloxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OC1COC1
InChIInChI=1S/C11H15NO2/c1-8(12)10-4-2-3-5-11(10)14-9-6-13-7-9/h2-5,8-9H,6-7,12H2,1H3
InChIKeyRBBUPPSHRTWPIL-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.48
Rot. Bonds3

About 1-[2-(oxetan-3-yloxy)phenyl]ethanamine

1-[2-(oxetan-3-yloxy)phenyl]ethanamine (PubChem CID 83484227) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-[2-(oxetan-3-yloxy)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(oxetan-3-yloxy)phenyl]ethanamine
PubChem CID83484227
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-[2-(oxetan-3-yloxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OC1COC1
InChIInChI=1S/C11H15NO2/c1-8(12)10-4-2-3-5-11(10)14-9-6-13-7-9/h2-5,8-9H,6-7,12H2,1H3
InChIKeyRBBUPPSHRTWPIL-UHFFFAOYSA-N
XLogP1.48
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(oxan-4-yloxy)phenyl]ethanamine
CID 61288976
2-[2-(oxetan-3-yloxy)phenyl]propan-1-ol
CID 117297539
N-ethyl-1-[2-(oxetan-3-yloxy)phenyl]ethanamine
CID 115669729
(1R)-1-[2-(3,4-dimethylcyclohexyl)oxyphenyl]ethanamine
CID 64744791
3-(2-methyl-3-propan-2-ylphenoxy)oxetane
CID 166788212
(1R)-1-[2-(4-ethylcyclohexyl)oxyphenyl]ethanamine
CID 78999303
(1S)-1-[2-(3-methylcyclohexyl)oxyphenyl]ethanamine
CID 78937930
1-[2-(1,1-dioxothiolan-3-yl)oxyphenyl]ethanamine
CID 54914959
1-[2-(oxolan-3-yloxy)phenyl]ethanol
CID 63558983
(1R)-1-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)phenyl]ethanamine
CID 78937787
2-[2-[(1S)-1-aminoethyl]phenoxy]cyclopentan-1-ol
CID 78936328
(1R)-1-(2-trimethylsilyloxyphenyl)ethanamine
CID 167729285

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxetan-3-yloxy)phenyl]ethanamine?
The IUPAC name of 1-[2-(oxetan-3-yloxy)phenyl]ethanamine (CID 83484227) is 1-[2-(oxetan-3-yloxy)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(oxetan-3-yloxy)phenyl]ethanamine?
The canonical SMILES for 1-[2-(oxetan-3-yloxy)phenyl]ethanamine is CC(N)c1ccccc1OC1COC1.
What is the InChIKey of 1-[2-(oxetan-3-yloxy)phenyl]ethanamine?
The InChIKey is RBBUPPSHRTWPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8(12)10-4-2-3-5-11(10)14-9-6-13-7-9/h2-5,8-9H,6-7,12H2,1H3.
What are the key properties of 1-[2-(oxetan-3-yloxy)phenyl]ethanamine?
1-[2-(oxetan-3-yloxy)phenyl]ethanamine has a molecular weight of 193.25 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxetan-3-yloxy)phenyl]ethanamine is sourced from PubChem (CID 83484227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).