2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide

C15H11BrF3NO2 — CID 1177163

IUPAC2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(COc1ccc(Br)cc1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H11BrF3NO2/c16-11-4-6-13(7-5-11)22-9-14(21)20-12-3-1-2-10(8-12)15(17,18)19/h1-8H,9H2,(H,20,21)
InChIKeyGCFZFSPEFQKCSY-UHFFFAOYSA-N
MW374.16 g/mol
LogP4.49
Rot. Bonds4

About 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide

2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 1177163) has the molecular formula C15H11BrF3NO2 and a molecular weight of 374.16 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID1177163
Molecular FormulaC15H11BrF3NO2
Molecular Weight374.16 g/mol
Exact Mass372.99
IUPAC Name2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(COc1ccc(Br)cc1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H11BrF3NO2/c16-11-4-6-13(7-5-11)22-9-14(21)20-12-3-1-2-10(8-12)15(17,18)19/h1-8H,9H2,(H,20,21)
InChIKeyGCFZFSPEFQKCSY-UHFFFAOYSA-N
XLogP4.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.16
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(4-bromophenoxy)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 28639192
(3Z)-3-[[2-(4-bromophenoxy)acetyl]hydrazinylidene]-N-[3-(trifluoromethyl)phenyl]butanamide
CID 6175992
2-(4-bromophenoxy)-N-(3-bromophenyl)acetamide
CID 2631877
2-(4-bromo-2,6-dimethylphenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 17197570
2-[4-(2-methoxyethyl)phenoxy]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2126324
2-[4-(pyrrolidine-1-carbothioyl)phenoxy]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 126247714
N-[3-(2-anilino-2-oxoethoxy)phenyl]-2-(4-bromophenoxy)acetamide
CID 55901957
2-phenoxy-N-[4-[3-(trifluoromethyl)anilino]phenyl]acetamide
CID 112988067
2-(3-propoxyphenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 4733098
3-[[2-(4-cyanophenoxy)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 16552434
N-[3-(phenylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 55524065
2-methyl-N-[3-[2-oxo-2-[3-(trifluoromethyl)anilino]ethoxy]phenyl]propanamide
CID 18870141

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide (CID 1177163) is 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide is O=C(COc1ccc(Br)cc1)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is GCFZFSPEFQKCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrF3NO2/c16-11-4-6-13(7-5-11)22-9-14(21)20-12-3-1-2-10(8-12)15(17,18)19/h1-8H,9H2,(H,20,21).
What are the key properties of 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide?
2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 374.16 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 1177163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).