N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide

C15H12F3NO3 — CID 164545151

IUPACN-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESO=C(COc1ccccc1C(F)(F)F)Nc1ccc(O)cc1
InChIInChI=1S/C15H12F3NO3/c16-15(17,18)12-3-1-2-4-13(12)22-9-14(21)19-10-5-7-11(20)8-6-10/h1-8,20H,9H2,(H,19,21)
InChIKeyIPQRQEYUJLSWGZ-UHFFFAOYSA-N
MW311.26 g/mol
LogP3.43
Rot. Bonds4

About N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide

N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide (PubChem CID 164545151) has the molecular formula C15H12F3NO3 and a molecular weight of 311.26 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
PubChem CID164545151
Molecular FormulaC15H12F3NO3
Molecular Weight311.26 g/mol
Exact Mass311.08
IUPAC NameN-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESO=C(COc1ccccc1C(F)(F)F)Nc1ccc(O)cc1
InChIInChI=1S/C15H12F3NO3/c16-15(17,18)12-3-1-2-4-13(12)22-9-14(21)19-10-5-7-11(20)8-6-10/h1-8,20H,9H2,(H,19,21)
InChIKeyIPQRQEYUJLSWGZ-UHFFFAOYSA-N
XLogP3.43
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.26
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-4-[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 46686486
N-(4-hydroxyphenyl)-2-(2-methylphenoxy)acetamide
CID 38113216
N-pyridin-3-yl-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 75414453
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 46686572
[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]thiourea
CID 87565289
2-(2-chlorophenoxy)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 19171328
N-(2,5-difluorophenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39088986
N-[2,6-di(propan-2-yl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39088271
N-(2-pyrrolidin-1-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39095289
2-(4-fluorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 9323790
4-tert-butyl-N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]benzamide
CID 17235093
methyl 2-hydroxy-3-[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]benzoate
CID 56543418

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide (CID 164545151) is N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide is O=C(COc1ccccc1C(F)(F)F)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is IPQRQEYUJLSWGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO3/c16-15(17,18)12-3-1-2-4-13(12)22-9-14(21)19-10-5-7-11(20)8-6-10/h1-8,20H,9H2,(H,19,21).
What are the key properties of N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 311.26 g/mol, XLogP of 3.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 164545151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).