3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one

C20H20F3N3O3 — CID 71120857

IUPAC3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(N2CCC(Oc3ccccc3C(F)(F)F)CC2)nc1
InChIInChI=1S/C20H20F3N3O3/c21-20(22,23)16-3-1-2-4-17(16)29-15-7-9-25(10-8-15)18-6-5-14(13-24-18)26-11-12-28-19(26)27/h1-6,13,15H,7-12H2
InChIKeyPRSYNAFANZWGLK-UHFFFAOYSA-N
MW407.39 g/mol
LogP4.10
Rot. Bonds4

About 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one

3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one (PubChem CID 71120857) has the molecular formula C20H20F3N3O3 and a molecular weight of 407.39 g/mol. Its IUPAC name is 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one
PubChem CID71120857
Molecular FormulaC20H20F3N3O3
Molecular Weight407.39 g/mol
Exact Mass407.15
IUPAC Name3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(N2CCC(Oc3ccccc3C(F)(F)F)CC2)nc1
InChIInChI=1S/C20H20F3N3O3/c21-20(22,23)16-3-1-2-4-17(16)29-15-7-9-25(10-8-15)18-6-5-14(13-24-18)26-11-12-28-19(26)27/h1-6,13,15H,7-12H2
InChIKeyPRSYNAFANZWGLK-UHFFFAOYSA-N
XLogP4.10
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.39
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one 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-[6-[4-(2-fluorophenoxy)piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one
CID 143639052
2-[1-[5-(2-oxo-1,3-oxazolidin-3-yl)-2-pyridinyl]piperidin-4-yl]oxybenzonitrile
CID 71120836
1-(5-bromo-2-pyridinyl)piperidin-4-ol;5-bromo-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]pyridine;1-fluoro-2-(trifluoromethyl)benzene
CID 158018417
(5R)-3-[6-[4-(2-chlorophenoxy)piperidin-1-yl]-3-pyridinyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 24997055
(5S)-3-[6-[3-(2-fluorophenoxy)pyrrolidin-1-yl]-3-pyridinyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 143639048
5-(1H-pyrazol-4-yl)-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]pyrimidine
CID 141215372
3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]pyridazin-3-yl]phenol
CID 71083472
5-methyl-2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-6,7a-dihydro-3aH-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 164906021
2-[3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]-1,3-thiazole
CID 91253125
(5R)-5-(fluoromethyl)-3-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one
CID 24996733
ethane;2-methylpropane;3-[5-(trifluoromethyl)-2-pyridinyl]-1,3-oxazolidin-2-one
CID 143049847
3-[5-[[2-chloro-6-(trifluoromethyl)phenyl]methoxy]-2-pyridinyl]-1,3-oxazolidin-2-one
CID 170609039

Frequently Asked Questions

What is the IUPAC name of 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one (CID 71120857) is 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one is O=C1OCCN1c1ccc(N2CCC(Oc3ccccc3C(F)(F)F)CC2)nc1.
What is the InChIKey of 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one?
The InChIKey is PRSYNAFANZWGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F3N3O3/c21-20(22,23)16-3-1-2-4-17(16)29-15-7-9-25(10-8-15)18-6-5-14(13-24-18)26-11-12-28-19(26)27/h1-6,13,15H,7-12H2.
What are the key properties of 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one?
3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one has a molecular weight of 407.39 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-3-pyridinyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 71120857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).