N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide

C19H16F3NO3 — CID 42926696

IUPACN-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESCC(NC(=O)COc1ccccc1C(F)(F)F)c1cc2ccccc2o1
InChIInChI=1S/C19H16F3NO3/c1-12(17-10-13-6-2-4-8-15(13)26-17)23-18(24)11-25-16-9-5-3-7-14(16)19(20,21)22/h2-10,12H,11H2,1H3,(H,23,24)
InChIKeyVDILECSLUQBDPN-UHFFFAOYSA-N
MW363.34 g/mol
LogP4.71
Rot. Bonds5

About N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide

N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide (PubChem CID 42926696) has the molecular formula C19H16F3NO3 and a molecular weight of 363.34 g/mol. Its IUPAC name is N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
PubChem CID42926696
Molecular FormulaC19H16F3NO3
Molecular Weight363.34 g/mol
Exact Mass363.11
IUPAC NameN-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESCC(NC(=O)COc1ccccc1C(F)(F)F)c1cc2ccccc2o1
InChIInChI=1S/C19H16F3NO3/c1-12(17-10-13-6-2-4-8-15(13)26-17)23-18(24)11-25-16-9-5-3-7-14(16)19(20,21)22/h2-10,12H,11H2,1H3,(H,23,24)
InChIKeyVDILECSLUQBDPN-UHFFFAOYSA-N
XLogP4.71
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.34
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(2,5-dichlorophenoxy)acetamide
CID 8578495
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(2,4-dichlorophenoxy)acetamide
CID 9365848
2-[2-[[(1S)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxoethoxy]-N-benzylbenzamide
CID 41134830
[2-[[(1S)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxoethyl] 2-(2-chloro-4-fluorophenoxy)acetate
CID 8565719
4-[2-[[(1S)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxoethoxy]benzamide
CID 8566320
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(3-chlorophenoxy)acetamide
CID 9013193
(2R)-N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
CID 38929442
(2R)-N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
CID 38929440
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-3-(2-methylphenoxy)propanamide
CID 9366932
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(2-formyl-5-propoxyphenoxy)acetamide
CID 9017734
N-[1-(4-ethoxyphenyl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 55607800
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[(4-fluorophenyl)sulfonylamino]oxyacetamide
CID 9367877

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide (CID 42926696) is N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide is CC(NC(=O)COc1ccccc1C(F)(F)F)c1cc2ccccc2o1.
What is the InChIKey of N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is VDILECSLUQBDPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F3NO3/c1-12(17-10-13-6-2-4-8-15(13)26-17)23-18(24)11-25-16-9-5-3-7-14(16)19(20,21)22/h2-10,12H,11H2,1H3,(H,23,24).
What are the key properties of N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 363.34 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-benzofuran-2-yl)ethyl]-2-[2-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 42926696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).