N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide

C18H18F3NO4 — CID 2443858

IUPACN-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2cccc(C(F)(F)F)c2)cc(OC)c1OC
InChIInChI=1S/C18H18F3NO4/c1-24-14-7-11(8-15(25-2)17(14)26-3)9-16(23)22-13-6-4-5-12(10-13)18(19,20)21/h4-8,10H,9H2,1-3H3,(H,22,23)
InChIKeyVEVLWBWNNDAKAV-UHFFFAOYSA-N
MW369.34 g/mol
LogP3.91
Rot. Bonds6

About N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide

N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 2443858) has the molecular formula C18H18F3NO4 and a molecular weight of 369.34 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID2443858
Molecular FormulaC18H18F3NO4
Molecular Weight369.34 g/mol
Exact Mass369.12
IUPAC NameN-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2cccc(C(F)(F)F)c2)cc(OC)c1OC
InChIInChI=1S/C18H18F3NO4/c1-24-14-7-11(8-15(25-2)17(14)26-3)9-16(23)22-13-6-4-5-12(10-13)18(19,20)21/h4-8,10H,9H2,1-3H3,(H,22,23)
InChIKeyVEVLWBWNNDAKAV-UHFFFAOYSA-N
XLogP3.91
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.34
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4,5-Trimethoxybenzanilide
CID 305103
(3E)-6-methoxy-3-[(3,4,5-trimethoxyphenyl)methylidene]-1H-indol-2-one
CID 11544661
N-(3-acetylphenyl)-3,4,5-trimethoxybenzamide
CID 692750
N-(3-acetylphenyl)-3,4-dimethoxybenzamide
CID 2171051
p-Benzotoluidide, 3,4,5-trimethoxy-
CID 12924
3,4,5-Trimethoxy-N-(2-methoxyphenyl)benzamide
CID 199280
4'-Dimethylamino-3,4,5-trimethoxy benzanilide
CID 43380
N-(9H-Fluoren-2-YL)-3,4,5-trimethoxybenzamide
CID 1273134
3,4,5-Trimethoxy-N-(4-methoxyphenyl)benzamide
CID 364715
N-(3-ethylphenyl)-3,4,5-trimethoxybenzamide
CID 897201
[1-(4-Ethylanilino)-1-oxopropan-2-yl] 2-(3,4,5-trimethoxyphenyl)acetate
CID 4564616
2-(3,4-dimethoxyphenyl)-N-(2-phenylphenyl)acetamide
CID 7770013

Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide (CID 2443858) is N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(CC(=O)Nc2cccc(C(F)(F)F)c2)cc(OC)c1OC.
What is the InChIKey of N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is VEVLWBWNNDAKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3NO4/c1-24-14-7-11(8-15(25-2)17(14)26-3)9-16(23)22-13-6-4-5-12(10-13)18(19,20)21/h4-8,10H,9H2,1-3H3,(H,22,23).
What are the key properties of N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 369.34 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 2443858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).