2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide

C11H13F3N2O3 — CID 79463675

IUPAC2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
SMILESNCCOCC(=O)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-4-2-1-3-8(9)16-10(17)7-18-6-5-15/h1-4H,5-7,15H2,(H,16,17)
InChIKeyLFYCJHMTLGPDHY-UHFFFAOYSA-N
MW278.23 g/mol
LogP1.50
Rot. Bonds6

About 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide

2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide (PubChem CID 79463675) has the molecular formula C11H13F3N2O3 and a molecular weight of 278.23 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
PubChem CID79463675
Molecular FormulaC11H13F3N2O3
Molecular Weight278.23 g/mol
Exact Mass278.09
IUPAC Name2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
SMILESNCCOCC(=O)Nc1ccccc1OC(F)(F)F
InChIInChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-4-2-1-3-8(9)16-10(17)7-18-6-5-15/h1-4H,5-7,15H2,(H,16,17)
InChIKeyLFYCJHMTLGPDHY-UHFFFAOYSA-N
XLogP1.50
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-phenoxyethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 55759707
3-bromo-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 112683678
2-(2-aminoethoxy)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 79474018
N-(2-aminophenyl)-N'-[2-(trifluoromethoxy)phenyl]heptanediamide
CID 45256999
2-(2-aminoethoxy)-N-(2-propan-2-ylphenyl)acetamide
CID 79463489
2-(3-aminopropoxy)-N-(2-methoxyphenyl)acetamide
CID 62343841
2-(4-methylphenoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 35202525
6-oxo-6-[2-(trifluoromethoxy)anilino]hexanoic acid
CID 43529543
2-(2-aminoethoxy)-N-(5-hydroxynaphthalen-1-yl)acetamide
CID 79473649
3-(ethylamino)-N-[2-(trifluoromethoxy)phenyl]propanamide
CID 62832471
2-(3-fluorophenyl)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 24525372
N-[4-bromo-2-(trifluoromethoxy)phenyl]-2-propoxyacetamide
CID 103275037

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide (CID 79463675) is 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide is NCCOCC(=O)Nc1ccccc1OC(F)(F)F.
What is the InChIKey of 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is LFYCJHMTLGPDHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-4-2-1-3-8(9)16-10(17)7-18-6-5-15/h1-4H,5-7,15H2,(H,16,17).
What are the key properties of 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide?
2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 278.23 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 79463675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).