3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide

C19H19F3N2O3 — CID 46691343

IUPAC3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide
SMILESCC(=O)NC(CC(=O)Nc1ccccc1OC(F)(F)F)c1ccc(C)cc1
InChIInChI=1S/C19H19F3N2O3/c1-12-7-9-14(10-8-12)16(23-13(2)25)11-18(26)24-15-5-3-4-6-17(15)27-19(20,21)22/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyXOJNEOKBCWAAKZ-UHFFFAOYSA-N
MW380.37 g/mol
LogP4.10
Rot. Bonds6

About 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide

3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide (PubChem CID 46691343) has the molecular formula C19H19F3N2O3 and a molecular weight of 380.37 g/mol. Its IUPAC name is 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide.

Molecular Properties

Compound Name3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide
PubChem CID46691343
Molecular FormulaC19H19F3N2O3
Molecular Weight380.37 g/mol
Exact Mass380.13
IUPAC Name3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide
SMILESCC(=O)NC(CC(=O)Nc1ccccc1OC(F)(F)F)c1ccc(C)cc1
InChIInChI=1S/C19H19F3N2O3/c1-12-7-9-14(10-8-12)16(23-13(2)25)11-18(26)24-15-5-3-4-6-17(15)27-19(20,21)22/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyXOJNEOKBCWAAKZ-UHFFFAOYSA-N
XLogP4.10
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.37
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]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

3-acetamido-N-(2-bromophenyl)-3-(4-methylphenyl)propanamide
CID 51194779
(3S)-3-acetamido-N-(2-methoxyphenyl)-3-phenylpropanamide
CID 41075346
(3R)-3-acetamido-3-phenyl-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide
CID 41188300
2-(4-methylphenoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 35202525
3-acetamido-3-[2-(trifluoromethoxy)phenyl]propanoic acid
CID 63651895
(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
CID 2599103
(3R)-3-acetamido-N-(4-methylphenyl)-3-phenylpropanamide
CID 2664823
(3S)-3-acetamido-3-(4-methylphenyl)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 26700777
3-acetamido-N-(2-hydroxy-4-methylphenyl)-3-(4-methylphenyl)propanamide
CID 46690602
3-acetamido-3-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 51314280
2-[[3-acetamido-3-(4-methylphenyl)propanoyl]amino]-N-cyclopropylbenzamide
CID 51312955
3-acetamido-3-(4-methoxyphenyl)-N-[2-(trifluoromethylsulfanyl)phenyl]propanamide
CID 78878766

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide?
The IUPAC name of 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide (CID 46691343) is 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide.
What is the SMILES notation for 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide?
The canonical SMILES for 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide is CC(=O)NC(CC(=O)Nc1ccccc1OC(F)(F)F)c1ccc(C)cc1.
What is the InChIKey of 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide?
The InChIKey is XOJNEOKBCWAAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O3/c1-12-7-9-14(10-8-12)16(23-13(2)25)11-18(26)24-15-5-3-4-6-17(15)27-19(20,21)22/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide?
3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide has a molecular weight of 380.37 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-(4-methylphenyl)-N-[2-(trifluoromethoxy)phenyl]propanamide is sourced from PubChem (CID 46691343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).