N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide

C15H10BrClN2O2 — CID 80710351

IUPACN-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide
SMILESN#Cc1ccc(Cl)cc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C15H10BrClN2O2/c16-11-2-5-13(6-3-11)19-15(20)9-21-14-7-12(17)4-1-10(14)8-18/h1-7H,9H2,(H,19,20)
InChIKeyRVYJKHZOKCDQSU-UHFFFAOYSA-N
MW365.61 g/mol
LogP3.99
Rot. Bonds4

About N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide

N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide (PubChem CID 80710351) has the molecular formula C15H10BrClN2O2 and a molecular weight of 365.61 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide
PubChem CID80710351
Molecular FormulaC15H10BrClN2O2
Molecular Weight365.61 g/mol
Exact Mass363.96
IUPAC NameN-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide
SMILESN#Cc1ccc(Cl)cc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C15H10BrClN2O2/c16-11-2-5-13(6-3-11)19-15(20)9-21-14-7-12(17)4-1-10(14)8-18/h1-7H,9H2,(H,19,20)
InChIKeyRVYJKHZOKCDQSU-UHFFFAOYSA-N
XLogP3.99
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.61
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-2-cyanophenoxy)-N-(4-fluorophenyl)acetamide
CID 80611460
N-tert-butyl-2-(5-chloro-2-cyanophenoxy)acetamide
CID 80708020
2-(5-chloro-2-cyanophenoxy)-N-propylacetamide
CID 80708099
N-(4-acetylphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 724281
N-butan-2-yl-2-(5-chloro-2-cyanophenoxy)acetamide
CID 80708257
N-benzyl-2-(5-chloro-2-cyanophenoxy)acetamide
CID 80712025
N-(4-bromophenyl)-2-(4-cyanophenoxy)acetamide
CID 7818711
5-chloro-2-[2-(4-cyanoanilino)-2-oxoethoxy]benzamide
CID 7893868
N-(4-aminophenyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 29276938
2-(2-bromo-4-chlorophenoxy)-N-[4-[4-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]phenoxy]phenyl]acetamide
CID 5229732
2-(4-bromo-2-tert-butylphenoxy)-N-(4-chlorophenyl)acetamide
CID 7721430
2-(2-bromo-4-chlorophenoxy)-N-(3-cyanothiophen-2-yl)acetamide
CID 2117847

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide (CID 80710351) is N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide is N#Cc1ccc(Cl)cc1OCC(=O)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide?
The InChIKey is RVYJKHZOKCDQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClN2O2/c16-11-2-5-13(6-3-11)19-15(20)9-21-14-7-12(17)4-1-10(14)8-18/h1-7H,9H2,(H,19,20).
What are the key properties of N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide?
N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide has a molecular weight of 365.61 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(5-chloro-2-cyanophenoxy)acetamide is sourced from PubChem (CID 80710351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).