N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide

C19H17F3N2O3 — CID 113175214

IUPACN-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide
SMILESCC(=O)c1ccc(NC(=O)CN(C(C)=O)c2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C19H17F3N2O3/c1-12(25)14-6-8-16(9-7-14)23-18(27)11-24(13(2)26)17-5-3-4-15(10-17)19(20,21)22/h3-10H,11H2,1-2H3,(H,23,27)
InChIKeyNXZCBASHZMJXSO-UHFFFAOYSA-N
MW378.35 g/mol
LogP3.90
Rot. Bonds5

About N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide

N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide (PubChem CID 113175214) has the molecular formula C19H17F3N2O3 and a molecular weight of 378.35 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide
PubChem CID113175214
Molecular FormulaC19H17F3N2O3
Molecular Weight378.35 g/mol
Exact Mass378.12
IUPAC NameN-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide
SMILESCC(=O)c1ccc(NC(=O)CN(C(C)=O)c2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C19H17F3N2O3/c1-12(25)14-6-8-16(9-7-14)23-18(27)11-24(13(2)26)17-5-3-4-15(10-17)19(20,21)22/h3-10H,11H2,1-2H3,(H,23,27)
InChIKeyNXZCBASHZMJXSO-UHFFFAOYSA-N
XLogP3.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.35
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N,3-diacetylanilino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113175504
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(2,6-difluorophenyl)acetamide
CID 113175232
methyl 3-[acetyl-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]amino]benzoate
CID 113176312
N-(4-acetylphenyl)-N'-[3-(trifluoromethyl)phenyl]propanediamide
CID 108956065
2-(N-acetyl-3,4-dimethylanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 113168375
2-(N,3-diacetylanilino)-N-phenylacetamide
CID 113175453
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-prop-2-enylacetamide
CID 113175103
2-(N-acetyl-3,5-dimethylanilino)-N-(4-acetylphenyl)acetamide
CID 113168572
2-(3-acetamido-N-acetylanilino)-N-(4-acetamidophenyl)acetamide
CID 113175847
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide
CID 113175197
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-benzylacetamide
CID 113175125
methyl 4-[acetyl-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]amino]benzoate
CID 113176468

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide (CID 113175214) is N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide is CC(=O)c1ccc(NC(=O)CN(C(C)=O)c2cccc(C(F)(F)F)c2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide?
The InChIKey is NXZCBASHZMJXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N2O3/c1-12(25)14-6-8-16(9-7-14)23-18(27)11-24(13(2)26)17-5-3-4-15(10-17)19(20,21)22/h3-10H,11H2,1-2H3,(H,23,27).
What are the key properties of N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide?
N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide has a molecular weight of 378.35 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 113175214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).