N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide

C23H21FN2O2 — CID 55779002

IUPACN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide
SMILESO=C(CCc1ccc(F)cc1)NC(C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C23H21FN2O2/c24-19-14-11-17(12-15-19)13-16-21(27)26-22(18-7-3-1-4-8-18)23(28)25-20-9-5-2-6-10-20/h1-12,14-15,22H,13,16H2,(H,25,28)(H,26,27)
InChIKeyOLAKTZMLBRCNCR-UHFFFAOYSA-N
MW376.43 g/mol
LogP4.25
Rot. Bonds7

About N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide

N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide (PubChem CID 55779002) has the molecular formula C23H21FN2O2 and a molecular weight of 376.43 g/mol. Its IUPAC name is N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide
PubChem CID55779002
Molecular FormulaC23H21FN2O2
Molecular Weight376.43 g/mol
Exact Mass376.16
IUPAC NameN-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide
SMILESO=C(CCc1ccc(F)cc1)NC(C(=O)Nc1ccccc1)c1ccccc1
InChIInChI=1S/C23H21FN2O2/c24-19-14-11-17(12-15-19)13-16-21(27)26-22(18-7-3-1-4-8-18)23(28)25-20-9-5-2-6-10-20/h1-12,14-15,22H,13,16H2,(H,25,28)(H,26,27)
InChIKeyOLAKTZMLBRCNCR-UHFFFAOYSA-N
XLogP4.25
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide 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-(2-anilino-2-oxo-1-phenylethyl)-3-(4-ethylphenyl)propanamide
CID 55726661
(2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-N,2-diphenylacetamide
CID 51957933
3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide
CID 47112649
(2S)-2-anilino-N-(4-fluorophenyl)-2-phenylacetamide
CID 7830464
3-(4-fluorophenyl)-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 94870735
3-(4-fluorophenyl)-N-[(2S)-4-phenylbutan-2-yl]propanamide
CID 95901327
4-[3-(4-fluorophenyl)propanoylamino]-4-phenylbutanoic acid
CID 119201110
2-(4-fluoroanilino)-N-(4-fluorophenyl)-2-phenylacetamide
CID 46799428
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-3-phenylpropanamide
CID 94514836
[(2R)-1-anilino-1-oxopropan-2-yl] 3-(4-fluorophenyl)propanoate
CID 8553372
4-fluoro-N-[(1S)-2-[4-(hydroxyamino)anilino]-2-oxo-1-phenylethyl]benzamide
CID 72705119
2-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]carbamoylamino]-N,2-diphenylacetamide
CID 55912566

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide?
The IUPAC name of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide (CID 55779002) is N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide.
What is the SMILES notation for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide?
The canonical SMILES for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide is O=C(CCc1ccc(F)cc1)NC(C(=O)Nc1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide?
The InChIKey is OLAKTZMLBRCNCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN2O2/c24-19-14-11-17(12-15-19)13-16-21(27)26-22(18-7-3-1-4-8-18)23(28)25-20-9-5-2-6-10-20/h1-12,14-15,22H,13,16H2,(H,25,28)(H,26,27).
What are the key properties of N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide?
N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide has a molecular weight of 376.43 g/mol, XLogP of 4.25, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxo-1-phenylethyl)-3-(4-fluorophenyl)propanamide is sourced from PubChem (CID 55779002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).