3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide

C19H19F3N2O3 — CID 4996386

IUPAC3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide
SMILESCOc1ccc(C(CC(=O)Nc2ccc(C)cc2)NC(=O)C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O3/c1-12-3-7-14(8-4-12)23-17(25)11-16(24-18(26)19(20,21)22)13-5-9-15(27-2)10-6-13/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyHUQWVJVVOVLDRI-UHFFFAOYSA-N
MW380.37 g/mol
LogP3.75
Rot. Bonds6

About 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide

3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide (PubChem CID 4996386) has the molecular formula C19H19F3N2O3 and a molecular weight of 380.37 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide
PubChem CID4996386
Molecular FormulaC19H19F3N2O3
Molecular Weight380.37 g/mol
Exact Mass380.13
IUPAC Name3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide
SMILESCOc1ccc(C(CC(=O)Nc2ccc(C)cc2)NC(=O)C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O3/c1-12-3-7-14(8-4-12)23-17(25)11-16(24-18(26)19(20,21)22)13-5-9-15(27-2)10-6-13/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyHUQWVJVVOVLDRI-UHFFFAOYSA-N
XLogP3.75
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 ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide (CID 4996386) is 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide is COc1ccc(C(CC(=O)Nc2ccc(C)cc2)NC(=O)C(F)(F)F)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide?
The InChIKey is HUQWVJVVOVLDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O3/c1-12-3-7-14(8-4-12)23-17(25)11-16(24-18(26)19(20,21)22)13-5-9-15(27-2)10-6-13/h3-10,16H,11H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide?
3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide has a molecular weight of 380.37 g/mol, XLogP of 3.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-(4-methylphenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanamide is sourced from PubChem (CID 4996386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).