2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide

C19H19F2NO4 — CID 78808116

IUPAC2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)NCCc2ccc(OC(F)F)cc2)c1
InChIInChI=1S/C19H19F2NO4/c1-13(23)15-3-2-4-17(11-15)25-12-18(24)22-10-9-14-5-7-16(8-6-14)26-19(20)21/h2-8,11,19H,9-10,12H2,1H3,(H,22,24)
InChIKeyZSTPRZUEHSKEBI-UHFFFAOYSA-N
MW363.36 g/mol
LogP3.23
Rot. Bonds9

About 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide

2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide (PubChem CID 78808116) has the molecular formula C19H19F2NO4 and a molecular weight of 363.36 g/mol. Its IUPAC name is 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
PubChem CID78808116
Molecular FormulaC19H19F2NO4
Molecular Weight363.36 g/mol
Exact Mass363.13
IUPAC Name2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)NCCc2ccc(OC(F)F)cc2)c1
InChIInChI=1S/C19H19F2NO4/c1-13(23)15-3-2-4-17(11-15)25-12-18(24)22-10-9-14-5-7-16(8-6-14)26-19(20)21/h2-8,11,19H,9-10,12H2,1H3,(H,22,24)
InChIKeyZSTPRZUEHSKEBI-UHFFFAOYSA-N
XLogP3.23
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[2-[4-(difluoromethoxy)phenyl]ethylamino]-2-oxoethyl] 3-methoxybenzoate
CID 9019272
[2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl] 2-(3-acetylphenoxy)acetate
CID 8840794
N-[2-[4-[2-(cyclopropylamino)-2-oxoethoxy]phenyl]ethyl]-3-(difluoromethoxy)benzamide
CID 55893056
3-[2-[2-(4-methoxyphenyl)ethylamino]-2-oxoethoxy]benzoic acid
CID 45396627
2-(3-acetylphenoxy)-N-(3-hydroxypropyl)acetamide
CID 78855114
N-[[4-(difluoromethoxy)phenyl]methyl]-2-(3-methylphenoxy)acetamide
CID 42007165
[2-[2-[4-(difluoromethoxy)phenyl]ethylamino]-2-oxoethyl] 3-fluorobenzoate
CID 9198602
2-(4-acetylphenoxy)-N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]acetamide
CID 17424738
3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide
CID 51160991
2-(3-acetylphenoxy)-N-[(4-chlorophenyl)methyl]acetamide
CID 2616931
3-(difluoromethoxy)-N'-[2-(3,4-dimethylphenoxy)acetyl]benzohydrazide
CID 26846150
2-amino-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide
CID 60672445

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide?
The IUPAC name of 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide (CID 78808116) is 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide?
The canonical SMILES for 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide is CC(=O)c1cccc(OCC(=O)NCCc2ccc(OC(F)F)cc2)c1.
What is the InChIKey of 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide?
The InChIKey is ZSTPRZUEHSKEBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2NO4/c1-13(23)15-3-2-4-17(11-15)25-12-18(24)22-10-9-14-5-7-16(8-6-14)26-19(20)21/h2-8,11,19H,9-10,12H2,1H3,(H,22,24).
What are the key properties of 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide?
2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide has a molecular weight of 363.36 g/mol, XLogP of 3.23, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylphenoxy)-N-[2-[4-(difluoromethoxy)phenyl]ethyl]acetamide is sourced from PubChem (CID 78808116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).