2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine

C32H36F4N2O2 — CID 67605531

IUPAC2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine
SMILESFc1cc(CCOC2OCCN(CCN3CCC(c4ccccc4)CC3)C2c2ccccc2)cc(C(F)(F)F)c1
InChIInChI=1S/C32H36F4N2O2/c33-29-22-24(21-28(23-29)32(34,35)36)13-19-39-31-30(27-9-5-2-6-10-27)38(18-20-40-31)17-16-37-14-11-26(12-15-37)25-7-3-1-4-8-25/h1-10,21-23,26,30-31H,11-20H2
InChIKeyIENQSTDVCWBCQL-UHFFFAOYSA-N
MW556.64 g/mol
LogP6.68
Rot. Bonds9

About 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine

2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine (PubChem CID 67605531) has the molecular formula C32H36F4N2O2 and a molecular weight of 556.64 g/mol. Its IUPAC name is 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine
PubChem CID67605531
Molecular FormulaC32H36F4N2O2
Molecular Weight556.64 g/mol
Exact Mass556.27
IUPAC Name2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine
SMILESFc1cc(CCOC2OCCN(CCN3CCC(c4ccccc4)CC3)C2c2ccccc2)cc(C(F)(F)F)c1
InChIInChI=1S/C32H36F4N2O2/c33-29-22-24(21-28(23-29)32(34,35)36)13-19-39-31-30(27-9-5-2-6-10-27)38(18-20-40-31)17-16-37-14-11-26(12-15-37)25-7-3-1-4-8-25/h1-10,21-23,26,30-31H,11-20H2
InChIKeyIENQSTDVCWBCQL-UHFFFAOYSA-N
XLogP6.68
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500556.64
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine 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

2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-(2-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylethyl)morpholine
CID 67691796
(2R,3S)-4-benzyl-3-(4-fluorophenyl)-2-[[3-fluoro-5-(trifluoromethyl)phenyl]methoxy]morpholine
CID 21308853
1-[5-[[2-[2-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenylmorpholin-4-yl]methyl]-2H-triazol-4-yl]-N,N-dimethylmethanamine
CID 87714444
6-[(2S,3R)-2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-phenylmorpholin-4-yl]hexanoic acid
CID 22860742
(2S,3S)-4-benzyl-2-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]butoxy]-3-phenylmorpholine
CID 10531317
(2R,3S)-3-(4-fluorophenyl)-2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]morpholine
CID 67760143
2-[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-phenylmorpholin-4-yl]acetamide
CID 10298340
5-[[2-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-phenylmorpholin-4-yl]methyl]-2,3-dihydro-1H-1,2,4-triazole-3-carbaldehyde
CID 174462319
(2R,3S)-4-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-(4-fluorophenyl)morpholin-2-ol
CID 142102328
(2R,3S)-2-[2-[4-fluoro-3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenylmorpholine
CID 54551610
2-[2-[4-fluoro-3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenylmorpholine
CID 57100259
4-phenyl-1-[2-[2-(trifluoromethyl)phenyl]ethyl]piperidine
CID 141379171

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine?
The IUPAC name of 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine (CID 67605531) is 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine.
What is the SMILES notation for 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine?
The canonical SMILES for 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine is Fc1cc(CCOC2OCCN(CCN3CCC(c4ccccc4)CC3)C2c2ccccc2)cc(C(F)(F)F)c1.
What is the InChIKey of 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine?
The InChIKey is IENQSTDVCWBCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H36F4N2O2/c33-29-22-24(21-28(23-29)32(34,35)36)13-19-39-31-30(27-9-5-2-6-10-27)38(18-20-40-31)17-16-37-14-11-26(12-15-37)25-7-3-1-4-8-25/h1-10,21-23,26,30-31H,11-20H2.
What are the key properties of 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine?
2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine has a molecular weight of 556.64 g/mol, XLogP of 6.68, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-fluoro-5-(trifluoromethyl)phenyl]ethoxy]-3-phenyl-4-[2-(4-phenylpiperidin-1-yl)ethyl]morpholine is sourced from PubChem (CID 67605531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).