N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide

C20H19F3N2O3 — CID 16894773

IUPACN-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide
SMILESO=C(NCC(=O)N1CCOC(c2ccccc2)C1)c1ccccc1C(F)(F)F
InChIInChI=1S/C20H19F3N2O3/c21-20(22,23)16-9-5-4-8-15(16)19(27)24-12-18(26)25-10-11-28-17(13-25)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H,24,27)
InChIKeyIYGOETXJYFFDQG-UHFFFAOYSA-N
MW392.38 g/mol
LogP3.04
Rot. Bonds4

About N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide

N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide (PubChem CID 16894773) has the molecular formula C20H19F3N2O3 and a molecular weight of 392.38 g/mol. Its IUPAC name is N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide
PubChem CID16894773
Molecular FormulaC20H19F3N2O3
Molecular Weight392.38 g/mol
Exact Mass392.13
IUPAC NameN-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide
SMILESO=C(NCC(=O)N1CCOC(c2ccccc2)C1)c1ccccc1C(F)(F)F
InChIInChI=1S/C20H19F3N2O3/c21-20(22,23)16-9-5-4-8-15(16)19(27)24-12-18(26)25-10-11-28-17(13-25)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H,24,27)
InChIKeyIYGOETXJYFFDQG-UHFFFAOYSA-N
XLogP3.04
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide?
The IUPAC name of N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide (CID 16894773) is N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide is O=C(NCC(=O)N1CCOC(c2ccccc2)C1)c1ccccc1C(F)(F)F.
What is the InChIKey of N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide?
The InChIKey is IYGOETXJYFFDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19F3N2O3/c21-20(22,23)16-9-5-4-8-15(16)19(27)24-12-18(26)25-10-11-28-17(13-25)14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H,24,27).
What are the key properties of N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide?
N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide has a molecular weight of 392.38 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 16894773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).