2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide

C11H12F3NO2 — CID 113225450

IUPAC2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCOC(C)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C11H12F3NO2/c1-7(17-2)10(16)15-9-6-4-3-5-8(9)11(12,13)14/h3-7H,1-2H3,(H,15,16)
InChIKeyKFLCUSNTMJTMEA-UHFFFAOYSA-N
MW247.22 g/mol
LogP2.68
Rot. Bonds3

About 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide

2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide (PubChem CID 113225450) has the molecular formula C11H12F3NO2 and a molecular weight of 247.22 g/mol. Its IUPAC name is 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide
PubChem CID113225450
Molecular FormulaC11H12F3NO2
Molecular Weight247.22 g/mol
Exact Mass247.08
IUPAC Name2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCOC(C)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C11H12F3NO2/c1-7(17-2)10(16)15-9-6-4-3-5-8(9)11(12,13)14/h3-7H,1-2H3,(H,15,16)
InChIKeyKFLCUSNTMJTMEA-UHFFFAOYSA-N
XLogP2.68
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-propan-2-ylphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 53266331
2-methoxy-N-[2-(2,2,2-trifluoroethoxy)phenyl]propanamide
CID 112685720
[1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl] 2-methylbenzoate
CID 4108022
2-(3,4-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 13052546
2-(2,3-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 46633814
2-methoxy-N-(2-propan-2-ylphenyl)propanamide
CID 86811936
N,N'-bis[2-(trifluoromethyl)phenyl]oxamide
CID 3696493
2-(4-acetamidoanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 51242154
(2S)-2-amino-3-methyl-N-[2-(trifluoromethyl)phenyl]pentanamide;hydrochloride
CID 52986036
2-(2,4-dibromophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 55418069
(2S)-2-(2,4-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 7720105
1-[(2S)-3-methylbutan-2-yl]-3-[2-(trifluoromethyl)phenyl]urea
CID 51944178

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide (CID 113225450) is 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide is COC(C)C(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide?
The InChIKey is KFLCUSNTMJTMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3NO2/c1-7(17-2)10(16)15-9-6-4-3-5-8(9)11(12,13)14/h3-7H,1-2H3,(H,15,16).
What are the key properties of 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide?
2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide has a molecular weight of 247.22 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 113225450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).