N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide

C19H15ClF3N3O4 — CID 166219619

IUPACN-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide
SMILESO=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1OCC(=O)N1CCNC1=O
InChIInChI=1S/C19H15ClF3N3O4/c20-14-6-5-11(9-13(14)19(21,22)23)25-17(28)12-3-1-2-4-15(12)30-10-16(27)26-8-7-24-18(26)29/h1-6,9H,7-8,10H2,(H,24,29)(H,25,28)
InChIKeyOFCVTFBOIFHUDI-UHFFFAOYSA-N
MW441.79 g/mol
LogP3.54
Rot. Bonds5

About N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide (PubChem CID 166219619) has the molecular formula C19H15ClF3N3O4 and a molecular weight of 441.79 g/mol. Its IUPAC name is N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide.

Molecular Properties

Compound NameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide
PubChem CID166219619
Molecular FormulaC19H15ClF3N3O4
Molecular Weight441.79 g/mol
Exact Mass441.07
IUPAC NameN-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide
SMILESO=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1OCC(=O)N1CCNC1=O
InChIInChI=1S/C19H15ClF3N3O4/c20-14-6-5-11(9-13(14)19(21,22)23)25-17(28)12-3-1-2-4-15(12)30-10-16(27)26-8-7-24-18(26)29/h1-6,9H,7-8,10H2,(H,24,29)(H,25,28)
InChIKeyOFCVTFBOIFHUDI-UHFFFAOYSA-N
XLogP3.54
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.79
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxybenzamide
CID 729859
2-(2-chlorophenoxy)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 19171328
1-[2-(2-bromophenoxy)acetyl]imidazolidin-2-one
CID 9466285
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-(dimethylamino)ethoxy]benzamide;2-ethoxy-N-[4-methyl-3-(trifluoromethyl)phenyl]benzamide
CID 161187250
2-bromo-N-[4-chloro-3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 103751854
N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-2-[2-(dimethylamino)-2-oxoethoxy]-N-methylbenzamide
CID 33086234
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 7930859
2-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-fluorobenzamide
CID 17168217
2-amino-N-[4-chloro-3-(trifluoromethyl)phenyl]-3-fluorobenzamide
CID 110452028
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(2-methoxyphenoxy)methyl]thiophene-2-carboxamide
CID 19496923
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-propan-2-ylsulfonylbenzamide
CID 39899496
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-ethoxy-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide
CID 67981550

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide?
The IUPAC name of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide (CID 166219619) is N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide.
What is the SMILES notation for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide?
The canonical SMILES for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide is O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1OCC(=O)N1CCNC1=O.
What is the InChIKey of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide?
The InChIKey is OFCVTFBOIFHUDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClF3N3O4/c20-14-6-5-11(9-13(14)19(21,22)23)25-17(28)12-3-1-2-4-15(12)30-10-16(27)26-8-7-24-18(26)29/h1-6,9H,7-8,10H2,(H,24,29)(H,25,28).
What are the key properties of N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide?
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide has a molecular weight of 441.79 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethoxy]benzamide is sourced from PubChem (CID 166219619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).