oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone

C16H18F3NO3 — CID 86786762

IUPACoxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
SMILESO=C(C1CCOC1)N1CCOC(c2ccccc2C(F)(F)F)C1
InChIInChI=1S/C16H18F3NO3/c17-16(18,19)13-4-2-1-3-12(13)14-9-20(6-8-23-14)15(21)11-5-7-22-10-11/h1-4,11,14H,5-10H2
InChIKeyBYTGGJKLLDXRJD-UHFFFAOYSA-N
MW329.32 g/mol
LogP2.64
Rot. Bonds2

About oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone

oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone (PubChem CID 86786762) has the molecular formula C16H18F3NO3 and a molecular weight of 329.32 g/mol. Its IUPAC name is oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Nameoxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
PubChem CID86786762
Molecular FormulaC16H18F3NO3
Molecular Weight329.32 g/mol
Exact Mass329.12
IUPAC Nameoxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
SMILESO=C(C1CCOC1)N1CCOC(c2ccccc2C(F)(F)F)C1
InChIInChI=1S/C16H18F3NO3/c17-16(18,19)13-4-2-1-3-12(13)14-9-20(6-8-23-14)15(21)11-5-7-22-10-11/h1-4,11,14H,5-10H2
InChIKeyBYTGGJKLLDXRJD-UHFFFAOYSA-N
XLogP2.64
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.32
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone 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

(1-methylpyrazol-4-yl)-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
CID 75501601
cyclopentyl-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 71684127
3-methyl-5-[2-[2-(trifluoromethyl)phenyl]morpholine-4-carbonyl]-1H-pyridin-4-one
CID 136522206
[(2S)-2-(2-fluorophenyl)morpholin-4-yl]-[(3R)-pyrrolidin-3-yl]methanone
CID 124699072
[(3S)-oxolan-3-yl]-[(3R)-3-phenylazepan-1-yl]methanone
CID 129354509
tert-butyl 4-[2-(2-fluorophenyl)morpholine-4-carbonyl]piperidine-1-carboxylate
CID 110609370
1-(oxolan-3-yl)-2-[2-(trifluoromethyl)phenoxy]ethanone
CID 104693489
[2-(2-chlorophenyl)morpholin-4-yl]-piperidin-3-ylmethanone
CID 119318503
[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 95894763
[(1R,3S)-3-aminocyclohexyl]-[(2R)-2-(2-methylphenyl)morpholin-4-yl]methanone
CID 125153639
(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
CID 75921285
morpholin-4-yl-[1-[2-(trifluoromethyl)benzoyl]piperidin-3-yl]methanone
CID 55517643

Frequently Asked Questions

What is the IUPAC name of oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The IUPAC name of oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone (CID 86786762) is oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone.
What is the SMILES notation for oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The canonical SMILES for oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone is O=C(C1CCOC1)N1CCOC(c2ccccc2C(F)(F)F)C1.
What is the InChIKey of oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The InChIKey is BYTGGJKLLDXRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18F3NO3/c17-16(18,19)13-4-2-1-3-12(13)14-9-20(6-8-23-14)15(21)11-5-7-22-10-11/h1-4,11,14H,5-10H2.
What are the key properties of oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone has a molecular weight of 329.32 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-3-yl-[2-[2-(trifluoromethyl)phenyl]morpholin-4-yl]methanone is sourced from PubChem (CID 86786762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).