4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide

C20H21F3N2O3 — CID 44534358

IUPAC4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc(O)c(-c2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C20H21F3N2O3/c21-20(22,23)16-3-1-2-14(12-16)17-13-15(4-5-18(17)26)19(27)24-6-7-25-8-10-28-11-9-25/h1-5,12-13,26H,6-11H2,(H,24,27)
InChIKeyULEMYFZXRSIDNR-UHFFFAOYSA-N
MW394.39 g/mol
LogP3.14
Rot. Bonds5

About 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide

4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide (PubChem CID 44534358) has the molecular formula C20H21F3N2O3 and a molecular weight of 394.39 g/mol. Its IUPAC name is 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide
PubChem CID44534358
Molecular FormulaC20H21F3N2O3
Molecular Weight394.39 g/mol
Exact Mass394.15
IUPAC Name4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc(O)c(-c2cccc(C(F)(F)F)c2)c1
InChIInChI=1S/C20H21F3N2O3/c21-20(22,23)16-3-1-2-14(12-16)17-13-15(4-5-18(17)26)19(27)24-6-7-25-8-10-28-11-9-25/h1-5,12-13,26H,6-11H2,(H,24,27)
InChIKeyULEMYFZXRSIDNR-UHFFFAOYSA-N
XLogP3.14
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.39
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide 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-Naphthalenecarboxamide, 3-hydroxy-N-[3-(4-morpholinyl)propyl]-
CID 82414
[4-hydroxy-3,5-di(propan-2-yl)phenyl]-[(2R)-2-methylmorpholin-4-yl]methanone
CID 118195560
[3-(1,1-Dimethylethyl)-4-hydroxyphenyl]-4-morpholinylmethanone
CID 46861554
(4-Hydroxy-3-propan-2-ylphenyl)-morpholin-4-ylmethanone
CID 46914873
3-(2-Hydroxy-phenyl)-N-(2-morpholin-4-yl-ethyl)-3-phenyl-propionamide
CID 655118
4-fluoro-N-{[1-(4-hydroxy-3,5-dimethylbenzyl)piperidin-3-yl]methyl}benzamide
CID 16189612
N-cyclohexyl-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44534359
N-[(2S)-3-cyclohexyl-1-(cyclopropylamino)-1-oxopropan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535267
N-[(2S)-3-cyclohexyl-1-oxo-1-(pentan-2-ylamino)propan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535268
N-[(2S)-1-(cyclohexylamino)-1-oxo-3-phenylpropan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535269
N-[(2S)-3-cyclohexyl-1-(cyclohexylamino)-1-oxopropan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535270
N-[(2S)-3-cyclohexyl-1-oxo-1-(2-pyrrolidin-1-ylethylamino)propan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535271

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide (CID 44534358) is 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide is O=C(NCCN1CCOCC1)c1ccc(O)c(-c2cccc(C(F)(F)F)c2)c1.
What is the InChIKey of 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide?
The InChIKey is ULEMYFZXRSIDNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21F3N2O3/c21-20(22,23)16-3-1-2-14(12-16)17-13-15(4-5-18(17)26)19(27)24-6-7-25-8-10-28-11-9-25/h1-5,12-13,26H,6-11H2,(H,24,27).
What are the key properties of 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide?
4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide has a molecular weight of 394.39 g/mol, XLogP of 3.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 44534358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).