N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide

C24H21F3N2O3 — CID 118247046

IUPACN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide
SMILESC[C@H](c1cccc(OC(F)(F)F)c1)N(C(=O)c1ccccc1)[C@@H](C(N)=O)c1ccccc1
InChIInChI=1S/C24H21F3N2O3/c1-16(19-13-8-14-20(15-19)32-24(25,26)27)29(23(31)18-11-6-3-7-12-18)21(22(28)30)17-9-4-2-5-10-17/h2-16,21H,1H3,(H2,28,30)/t16-,21-/m1/s1
InChIKeyRILYGRDJHPBEJH-IIBYNOLFSA-N
MW442.44 g/mol
LogP5.02
Rot. Bonds7

About N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide (PubChem CID 118247046) has the molecular formula C24H21F3N2O3 and a molecular weight of 442.44 g/mol. Its IUPAC name is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide
PubChem CID118247046
Molecular FormulaC24H21F3N2O3
Molecular Weight442.44 g/mol
Exact Mass442.15
IUPAC NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide
SMILESC[C@H](c1cccc(OC(F)(F)F)c1)N(C(=O)c1ccccc1)[C@@H](C(N)=O)c1ccccc1
InChIInChI=1S/C24H21F3N2O3/c1-16(19-13-8-14-20(15-19)32-24(25,26)27)29(23(31)18-11-6-3-7-12-18)21(22(28)30)17-9-4-2-5-10-17/h2-16,21H,1H3,(H2,28,30)/t16-,21-/m1/s1
InChIKeyRILYGRDJHPBEJH-IIBYNOLFSA-N
XLogP5.02
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.44
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]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

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]benzamide
CID 118247039
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-(3,5-difluorophenyl)ethyl]-4-(2,2,2-trifluoroethoxy)benzamide
CID 118246848
N-[(1R)-2-amino-2-oxo-1-pyridin-3-ylethyl]-N-[(1R)-1-(3-chlorophenyl)ethyl]benzamide
CID 118246949
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-(2,3-difluorophenyl)ethyl]benzamide
CID 118246986
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-(5-fluorothiophen-2-yl)ethyl]benzamide
CID 118246847
2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide
CID 107104709
(2R)-2-[3-(trifluoromethoxy)phenyl]propanoic acid
CID 175718270
N-[(1S)-2-amino-2-oxo-1-pyridin-2-ylethyl]-N-[(1R)-1-(3-chlorophenyl)ethyl]benzamide
CID 118246944
1-amino-1-[3-(trifluoromethoxy)phenyl]propan-2-one
CID 138110122
2-[acetyl(ethyl)amino]-2-[3-(trifluoromethoxy)phenyl]acetic acid
CID 107104773
(1S,2R)-1-amino-1-[3-(trifluoromethoxy)phenyl]propan-2-ol;hydrochloride
CID 171161777
2-cyclopropyl-1-[3-(trifluoromethoxy)phenyl]propan-1-amine
CID 115854106

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide?
The IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide (CID 118247046) is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide.
What is the SMILES notation for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide?
The canonical SMILES for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide is C[C@H](c1cccc(OC(F)(F)F)c1)N(C(=O)c1ccccc1)[C@@H](C(N)=O)c1ccccc1.
What is the InChIKey of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide?
The InChIKey is RILYGRDJHPBEJH-IIBYNOLFSA-N. The full InChI is InChI=1S/C24H21F3N2O3/c1-16(19-13-8-14-20(15-19)32-24(25,26)27)29(23(31)18-11-6-3-7-12-18)21(22(28)30)17-9-4-2-5-10-17/h2-16,21H,1H3,(H2,28,30)/t16-,21-/m1/s1.
What are the key properties of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide?
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide has a molecular weight of 442.44 g/mol, XLogP of 5.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-[3-(trifluoromethoxy)phenyl]ethyl]benzamide is sourced from PubChem (CID 118247046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).