2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide

C18H19F3N2O2 — CID 154721786

IUPAC2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide
SMILESCC(C)(Nc1ccc(C(F)(F)F)cc1)C(=O)NOCc1ccccc1
InChIInChI=1S/C18H19F3N2O2/c1-17(2,16(24)23-25-12-13-6-4-3-5-7-13)22-15-10-8-14(9-11-15)18(19,20)21/h3-11,22H,12H2,1-2H3,(H,23,24)
InChIKeyMOCVBIZPAUUJBJ-UHFFFAOYSA-N
MW352.36 g/mol
LogP4.14
Rot. Bonds6

About 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide

2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide (PubChem CID 154721786) has the molecular formula C18H19F3N2O2 and a molecular weight of 352.36 g/mol. Its IUPAC name is 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide.

Molecular Properties

Compound Name2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide
PubChem CID154721786
Molecular FormulaC18H19F3N2O2
Molecular Weight352.36 g/mol
Exact Mass352.14
IUPAC Name2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide
SMILESCC(C)(Nc1ccc(C(F)(F)F)cc1)C(=O)NOCc1ccccc1
InChIInChI=1S/C18H19F3N2O2/c1-17(2,16(24)23-25-12-13-6-4-3-5-7-13)22-15-10-8-14(9-11-15)18(19,20)21/h3-11,22H,12H2,1-2H3,(H,23,24)
InChIKeyMOCVBIZPAUUJBJ-UHFFFAOYSA-N
XLogP4.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.36
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]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-phenyl-N'-phenylmethoxyoctanediamide
CID 122177623
N-(2-aminophenyl)-N'-phenylmethoxyoctanediamide
CID 145986503
2-[(4-aminophenyl)methylcarbamoylamino]-N-ethyl-N-phenylmethoxyacetamide
CID 88940996
2-anilino-2-methyl-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]propanamide
CID 154721793
N-(3-fluoro-4-methylphenyl)-1-[(2-fluorophenyl)methoxy]-2-oxopyridine-3-carboxamide
CID 7190105
N-(2-cyano-4-fluorophenyl)-N'-methyl-N'-phenylmethoxyoxamide
CID 91650954
1-Benzyloxy-7-trifluoromethylquinoxaline-2,3(1H, 4H)-dione
CID 54449768
N-(4-(1-(((4-(Trifluoromethyl)benzyl)oxy)imino)propyl)phenyl)acetamide
CID 86699622
2-[(4-aminophenyl)methylcarbamoylamino]-N-ethyl-N-[(2-fluorophenyl)methoxy]acetamide
CID 87327438
N-[4-[(E)-C-ethyl-N-[[4-(trifluoromethyl)phenyl]methoxy]carbonimidoyl]phenyl]acetamide
CID 89858063
N-[3,5-bis(trifluoromethyl)phenyl]-2-[4-[[3-(trifluoromethyl)phenyl]methoxyamino]-3,6-dihydro-2H-pyridin-1-yl]acetamide
CID 91125281
2-oxo-N-phenyl-2-[4-[[3-(trifluoromethyl)phenyl]methoxyamino]-3,6-dihydro-2H-pyridin-1-yl]acetamide
CID 91475346

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide?
The IUPAC name of 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide (CID 154721786) is 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide.
What is the SMILES notation for 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide?
The canonical SMILES for 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide is CC(C)(Nc1ccc(C(F)(F)F)cc1)C(=O)NOCc1ccccc1.
What is the InChIKey of 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide?
The InChIKey is MOCVBIZPAUUJBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N2O2/c1-17(2,16(24)23-25-12-13-6-4-3-5-7-13)22-15-10-8-14(9-11-15)18(19,20)21/h3-11,22H,12H2,1-2H3,(H,23,24).
What are the key properties of 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide?
2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide has a molecular weight of 352.36 g/mol, XLogP of 4.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-phenylmethoxy-2-[4-(trifluoromethyl)anilino]propanamide is sourced from PubChem (CID 154721786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).