2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide

C14H9ClF3NO2 — CID 2633081

IUPAC2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C14H9ClF3NO2/c15-8-2-1-3-9(6-8)21-7-12(20)19-11-5-4-10(16)13(17)14(11)18/h1-6H,7H2,(H,19,20)
InChIKeyFFODCMFQFBOUOH-UHFFFAOYSA-N
MW315.68 g/mol
LogP3.77
Rot. Bonds4

About 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide

2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide (PubChem CID 2633081) has the molecular formula C14H9ClF3NO2 and a molecular weight of 315.68 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
PubChem CID2633081
Molecular FormulaC14H9ClF3NO2
Molecular Weight315.68 g/mol
Exact Mass315.03
IUPAC Name2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C14H9ClF3NO2/c15-8-2-1-3-9(6-8)21-7-12(20)19-11-5-4-10(16)13(17)14(11)18/h1-6H,7H2,(H,19,20)
InChIKeyFFODCMFQFBOUOH-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.68
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(3-chlorophenoxy)acetyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 7601440
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
CID 2707661
[2-(5-chloro-2-fluoroanilino)-2-oxoethyl] 2-(3-chlorophenoxy)acetate
CID 7803669
N-(5-chloro-2-fluorophenyl)-2-(3-methoxyphenoxy)acetamide
CID 112779285
2-[3-(aminomethyl)phenoxy]-N-(4-chloro-2-fluorophenyl)acetamide
CID 106485201
2-(4-bromophenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 2631889
2-(3-chlorophenoxy)-N-(6-fluoro-2-pyridinyl)acetamide
CID 104820485
N-[2-(chloromethyl)phenyl]-2-(3-chlorophenoxy)acetamide
CID 114298101
N-[4-chloro-2-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxyacetamide
CID 1247989
5-chloro-2-[2-oxo-2-(2,3,4-trifluoroanilino)ethoxy]benzamide
CID 7893862
2-(4-ethylphenoxy)-N-(2,3,4-trifluorophenyl)acetamide
CID 9095297
2-(3-chlorophenoxy)-N-(2-phenylphenyl)acetamide
CID 7818854

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide (CID 2633081) is 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide is O=C(COc1cccc(Cl)c1)Nc1ccc(F)c(F)c1F.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
The InChIKey is FFODCMFQFBOUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF3NO2/c15-8-2-1-3-9(6-8)21-7-12(20)19-11-5-4-10(16)13(17)14(11)18/h1-6H,7H2,(H,19,20).
What are the key properties of 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide?
2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide has a molecular weight of 315.68 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(2,3,4-trifluorophenyl)acetamide is sourced from PubChem (CID 2633081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).