3-ethyl-3-(phenylmethoxymethyl)oxetane

C13H18O2 — CID 22066200

IUPAC3-ethyl-3-(phenylmethoxymethyl)oxetane
SMILESCCC1(COCc2ccccc2)COC1
InChIInChI=1S/C13H18O2/c1-2-13(10-15-11-13)9-14-8-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3
InChIKeyDWFIEBGQPZWYND-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.63
Rot. Bonds5

About 3-ethyl-3-(phenylmethoxymethyl)oxetane

3-ethyl-3-(phenylmethoxymethyl)oxetane (PubChem CID 22066200) has the molecular formula C13H18O2 and a molecular weight of 206.29 g/mol. Its IUPAC name is 3-ethyl-3-(phenylmethoxymethyl)oxetane.

Molecular Properties

Compound Name3-ethyl-3-(phenylmethoxymethyl)oxetane
PubChem CID22066200
Molecular FormulaC13H18O2
Molecular Weight206.29 g/mol
Exact Mass206.13
IUPAC Name3-ethyl-3-(phenylmethoxymethyl)oxetane
SMILESCCC1(COCc2ccccc2)COC1
InChIInChI=1S/C13H18O2/c1-2-13(10-15-11-13)9-14-8-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3
InChIKeyDWFIEBGQPZWYND-UHFFFAOYSA-N
XLogP2.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-N,4-N-bis[4-(N-[4-[(3-ethyloxetan-3-yl)methoxymethyl]phenyl]anilino)phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
CID 59372141
3-(butoxymethyl)-3-ethyloxetane;3-ethyl-3-[2-[(3-ethyloxetan-3-yl)methoxy]ethoxymethyl]oxetane;3-ethyl-3-[[4-[(3-ethyloxetan-3-yl)methoxymethyl]phenyl]methoxymethyl]oxetane;3-ethyl-3-(phenylmethoxymethyl)oxetane
CID 159566916
[3-(hydroxymethyl)oxetan-3-yl]methanol;[3-(phenylmethoxymethyl)oxetan-3-yl]methanol
CID 159973315
3-ethyl-3-[(2-phenylphenyl)methoxymethyl]oxetane
CID 139890005
3-ethyl-3-[[4-[(3-ethyloxolan-3-yl)methoxymethyl]phenyl]methoxymethyl]oxolane
CID 143199326
3-ethyl-3-[(2-propylphenyl)methoxymethyl]oxetane
CID 174397153
N-[[3-(phenylmethoxymethyl)oxolan-3-yl]methyl]ethanamine
CID 102940530
3-ethyl-3-[[(E)-3-phenylprop-2-enoxy]methyl]oxetane
CID 20736586
2-methyl-2-(phenylmethoxymethyl)oxirane
CID 4613554
N-[[3-(phenylmethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
CID 102940532
3-ethyl-3-[5-[[4-[4-[10-[4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxymethyl]phenyl]anthracen-9-yl]naphthalen-1-yl]phenyl]methoxy]pentoxymethyl]oxetane
CID 137418163
3,3-bis(phenylmethoxymethyl)azetidine
CID 139666551

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-(phenylmethoxymethyl)oxetane?
The IUPAC name of 3-ethyl-3-(phenylmethoxymethyl)oxetane (CID 22066200) is 3-ethyl-3-(phenylmethoxymethyl)oxetane.
What is the SMILES notation for 3-ethyl-3-(phenylmethoxymethyl)oxetane?
The canonical SMILES for 3-ethyl-3-(phenylmethoxymethyl)oxetane is CCC1(COCc2ccccc2)COC1.
What is the InChIKey of 3-ethyl-3-(phenylmethoxymethyl)oxetane?
The InChIKey is DWFIEBGQPZWYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-2-13(10-15-11-13)9-14-8-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3.
What are the key properties of 3-ethyl-3-(phenylmethoxymethyl)oxetane?
3-ethyl-3-(phenylmethoxymethyl)oxetane has a molecular weight of 206.29 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-(phenylmethoxymethyl)oxetane is sourced from PubChem (CID 22066200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).