[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone

C19H20O3 — CID 90438012

IUPAC[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone
SMILESCCC1(COc2ccc(C(=O)c3ccccc3)cc2)COC1
InChIInChI=1S/C19H20O3/c1-2-19(12-21-13-19)14-22-17-10-8-16(9-11-17)18(20)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3
InChIKeyLMRJZLDYOCECHC-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.72
Rot. Bonds6

About [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone

[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone (PubChem CID 90438012) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone
PubChem CID90438012
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Name[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone
SMILESCCC1(COc2ccc(C(=O)c3ccccc3)cc2)COC1
InChIInChI=1S/C19H20O3/c1-2-19(12-21-13-19)14-22-17-10-8-16(9-11-17)18(20)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3
InChIKeyLMRJZLDYOCECHC-UHFFFAOYSA-N
XLogP3.72
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone 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

3-[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]propanoic acid
CID 59767606
[4-(trifluoromethoxy)phenyl] 4-[(3-ethyloxetan-3-yl)methoxy]benzoate
CID 59767520
2,5-bis[[4-[(3-ethyloxetan-3-yl)methoxy]benzoyl]oxy]benzoic acid
CID 59702732
3-[[4-[1,1-bis[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]ethyl]phenoxy]methyl]-3-ethyloxetane
CID 59386218
(3-ethyloxetan-3-yl)methanol;3-methyl-3-(phenoxymethyl)oxetane
CID 160629568
1-[4-[6-[(3-ethyloxetan-3-yl)methoxy]hexoxy]phenyl]ethanone
CID 59318851
[4-[(3,3-dimethyloxiran-2-yl)methoxy]phenyl]-phenylmethanone
CID 88845639
(3-ethyloxetan-3-yl)methyl 2,5-bis[[4-[(3-ethyloxetan-3-yl)methoxy]benzoyl]oxy]benzoate
CID 59702730
methyl 4-[4-[(3-ethyloxetan-3-yl)methoxy]butoxy]benzoate
CID 59197240
3-ethyl-3-[[4-[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]phenoxy]methyl]oxetane;(3-ethyloxetan-3-yl)methanol;(3-ethyloxetan-3-yl)methyl N-butylcarbamate;3-ethyl-3-(phenoxymethyl)oxetane
CID 159398466
[4-[4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoyl]oxyphenyl] 4-[5-[(3-ethyloxetan-3-yl)methoxy]pentoxy]benzoate
CID 102214597
4-[8-[4-[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]phenoxy]octoxy]phenol
CID 59711338

Frequently Asked Questions

What is the IUPAC name of [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone?
The IUPAC name of [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone (CID 90438012) is [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone.
What is the SMILES notation for [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone?
The canonical SMILES for [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone is CCC1(COc2ccc(C(=O)c3ccccc3)cc2)COC1.
What is the InChIKey of [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone?
The InChIKey is LMRJZLDYOCECHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c1-2-19(12-21-13-19)14-22-17-10-8-16(9-11-17)18(20)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3.
What are the key properties of [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone?
[4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone has a molecular weight of 296.37 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-ethyloxetan-3-yl)methoxy]phenyl]-phenylmethanone is sourced from PubChem (CID 90438012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).