2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide

C19H15F6N3O3 — CID 78831595

IUPAC2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
SMILESO=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C19H15F6N3O3/c20-18(21,22)11-7-12(19(23,24)25)9-15(8-11)31-10-16(29)27-13-1-3-14(4-2-13)28-6-5-26-17(28)30/h1-4,7-9H,5-6,10H2,(H,26,30)(H,27,29)
InChIKeySFVJQFFQDQNENU-UHFFFAOYSA-N
MW447.34 g/mol
LogP4.27
Rot. Bonds5

About 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide

2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide (PubChem CID 78831595) has the molecular formula C19H15F6N3O3 and a molecular weight of 447.34 g/mol. Its IUPAC name is 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
PubChem CID78831595
Molecular FormulaC19H15F6N3O3
Molecular Weight447.34 g/mol
Exact Mass447.10
IUPAC Name2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
SMILESO=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(N2CCNC2=O)cc1
InChIInChI=1S/C19H15F6N3O3/c20-18(21,22)11-7-12(19(23,24)25)9-15(8-11)31-10-16(29)27-13-1-3-14(4-2-13)28-6-5-26-17(28)30/h1-4,7-9H,5-6,10H2,(H,26,30)(H,27,29)
InChIKeySFVJQFFQDQNENU-UHFFFAOYSA-N
XLogP4.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.34
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-oxoimidazolidin-1-yl)phenyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 86991123
2-[[2-[3,5-bis(trifluoromethyl)phenoxy]acetyl]amino]-N-(4-fluorophenyl)acetamide
CID 16526088
2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 43709823
2-[3,5-bis(trifluoromethyl)phenoxy]-N-(4-sulfamoylphenyl)acetamide
CID 2080031
2-[3,5-bis(trifluoromethyl)phenoxy]-N-quinoxalin-6-ylacetamide
CID 112845789
4-[[2-[3,5-bis(trifluoromethyl)phenoxy]acetyl]amino]-N-ethylbenzamide
CID 112836068
N-[4-(2-oxoimidazolidin-1-yl)phenyl]-1-[3-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide
CID 55484939
2-[4-(2-oxoimidazolidin-1-yl)phenoxy]acetic acid
CID 63771692
4-(2-oxoimidazolidin-1-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 110860885
2-[3-(trifluoromethyl)phenoxy]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100757803
N-[4-(2-oxoimidazolidin-1-yl)phenyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 99170180
2-(3,4-dichlorophenyl)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 55489364

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide (CID 78831595) is 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide is O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(N2CCNC2=O)cc1.
What is the InChIKey of 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide?
The InChIKey is SFVJQFFQDQNENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F6N3O3/c20-18(21,22)11-7-12(19(23,24)25)9-15(8-11)31-10-16(29)27-13-1-3-14(4-2-13)28-6-5-26-17(28)30/h1-4,7-9H,5-6,10H2,(H,26,30)(H,27,29).
What are the key properties of 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide?
2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide has a molecular weight of 447.34 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,5-bis(trifluoromethyl)phenoxy]-N-[4-(2-oxoimidazolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 78831595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).