N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide

C20H15BrFNO2 — CID 7964936

IUPACN-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C20H15BrFNO2/c21-15-5-9-17(10-6-15)25-18-11-7-16(8-12-18)23-20(24)13-14-3-1-2-4-19(14)22/h1-12H,13H2,(H,23,24)
InChIKeyXTFOIXAMUJVSEE-UHFFFAOYSA-N
MW400.25 g/mol
LogP5.56
Rot. Bonds5

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

N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide (PubChem CID 7964936) has the molecular formula C20H15BrFNO2 and a molecular weight of 400.25 g/mol. Its IUPAC name is N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide
PubChem CID7964936
Molecular FormulaC20H15BrFNO2
Molecular Weight400.25 g/mol
Exact Mass399.03
IUPAC NameN-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C20H15BrFNO2/c21-15-5-9-17(10-6-15)25-18-11-7-16(8-12-18)23-20(24)13-14-3-1-2-4-19(14)22/h1-12H,13H2,(H,23,24)
InChIKeyXTFOIXAMUJVSEE-UHFFFAOYSA-N
XLogP5.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.25
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenyl)-N-(4-hydroxyphenyl)acetamide
CID 28739611
N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide
CID 4575386
2-(2-fluorophenyl)-N-(4-propoxyphenyl)acetamide
CID 110493409
N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
CID 7809057
N-[4-(4-fluoroanilino)phenyl]-2-(2-fluorophenyl)acetamide
CID 112986867
4-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 2677119
2,2,2-trifluoro-N-[4-[[2-(2-fluorophenyl)acetyl]amino]phenyl]acetamide
CID 108933170
N-(4-bromophenyl)-2-(2-methoxyphenyl)acetamide
CID 2263112
2-[4-[[2-(2-fluorophenyl)acetyl]amino]phenyl]-N-methylacetamide
CID 35364792
N-(5-bromonaphthalen-2-yl)-2-(2-fluorophenyl)acetamide
CID 146022091
2-(2-chloro-6-fluorophenyl)-N-(4-phenoxyphenyl)acetamide
CID 7914940
N-[4-(3,4-difluoroanilino)phenyl]-2-(2-fluorophenyl)acetamide
CID 112990293

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide (CID 7964936) is N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide is O=C(Cc1ccccc1F)Nc1ccc(Oc2ccc(Br)cc2)cc1.
What is the InChIKey of N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is XTFOIXAMUJVSEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrFNO2/c21-15-5-9-17(10-6-15)25-18-11-7-16(8-12-18)23-20(24)13-14-3-1-2-4-19(14)22/h1-12H,13H2,(H,23,24).
What are the key properties of N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide?
N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 400.25 g/mol, XLogP of 5.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 7964936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).