2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide

C15H10BrFN2O2 — CID 115918411

IUPAC2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide
SMILESN#Cc1ccccc1NC(=O)COc1cc(Br)ccc1F
InChIInChI=1S/C15H10BrFN2O2/c16-11-5-6-12(17)14(7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h1-7H,9H2,(H,19,20)
InChIKeyYWALSORMDCSPGC-UHFFFAOYSA-N
MW349.16 g/mol
LogP3.48
Rot. Bonds4

About 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide

2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide (PubChem CID 115918411) has the molecular formula C15H10BrFN2O2 and a molecular weight of 349.16 g/mol. Its IUPAC name is 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide
PubChem CID115918411
Molecular FormulaC15H10BrFN2O2
Molecular Weight349.16 g/mol
Exact Mass347.99
IUPAC Name2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide
SMILESN#Cc1ccccc1NC(=O)COc1cc(Br)ccc1F
InChIInChI=1S/C15H10BrFN2O2/c16-11-5-6-12(17)14(7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h1-7H,9H2,(H,19,20)
InChIKeyYWALSORMDCSPGC-UHFFFAOYSA-N
XLogP3.48
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.16
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64854041
N-(2-cyanophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 4511857
N-(2-cyanophenyl)-2-(2-methoxyphenoxy)acetamide
CID 922260
2-(2-bromo-4-tert-butylphenoxy)-N-(2-cyanophenyl)acetamide
CID 2203067
N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide
CID 26216328
N-(2-amino-5-fluorophenyl)-2-(5-bromo-2-fluorophenoxy)acetamide
CID 114671905
N-(2-cyanophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876328
2-(5-bromo-2-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 115918565
[2-(2-cyanoanilino)-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 7842616
N-(2-cyano-4-nitrophenyl)-2-(2-fluorophenoxy)acetamide
CID 7434030
N-(2-cyanophenyl)-4-(2-fluorophenoxy)butanamide
CID 43824295
2-(4-bromo-2-propan-2-ylphenoxy)-N-(2-fluorophenyl)acetamide
CID 17188911

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide?
The IUPAC name of 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide (CID 115918411) is 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide is N#Cc1ccccc1NC(=O)COc1cc(Br)ccc1F.
What is the InChIKey of 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide?
The InChIKey is YWALSORMDCSPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrFN2O2/c16-11-5-6-12(17)14(7-11)21-9-15(20)19-13-4-2-1-3-10(13)8-18/h1-7H,9H2,(H,19,20).
What are the key properties of 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide?
2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide has a molecular weight of 349.16 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide is sourced from PubChem (CID 115918411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).