N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide

C16H12BrN3O2 — CID 2096177

IUPACN-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide
SMILESO=C(COc1cnc2ccccc2n1)Nc1ccccc1Br
InChIInChI=1S/C16H12BrN3O2/c17-11-5-1-2-6-12(11)19-15(21)10-22-16-9-18-13-7-3-4-8-14(13)20-16/h1-9H,10H2,(H,19,21)
InChIKeyNNKSINFRBCGJND-UHFFFAOYSA-N
MW358.19 g/mol
LogP3.41
Rot. Bonds4

About N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide

N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide (PubChem CID 2096177) has the molecular formula C16H12BrN3O2 and a molecular weight of 358.19 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide
PubChem CID2096177
Molecular FormulaC16H12BrN3O2
Molecular Weight358.19 g/mol
Exact Mass357.01
IUPAC NameN-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide
SMILESO=C(COc1cnc2ccccc2n1)Nc1ccccc1Br
InChIInChI=1S/C16H12BrN3O2/c17-11-5-1-2-6-12(11)19-15(21)10-22-16-9-18-13-7-3-4-8-14(13)20-16/h1-9H,10H2,(H,19,21)
InChIKeyNNKSINFRBCGJND-UHFFFAOYSA-N
XLogP3.41
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.19
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromo-2-fluorophenyl)-2-quinoxalin-2-yloxyacetamide
CID 2124321
N-[2-(2-bromoanilino)-2-oxoethyl]quinoxaline-2-carboxamide
CID 9456802
N-(2-bromophenyl)quinoxaline-2-carboxamide
CID 17429565
N-(2-bromophenyl)-2-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]oxyacetamide
CID 53136821
N-[4-[(2R)-butan-2-yl]phenyl]-2-quinoxalin-2-yloxyacetamide
CID 2080749
N-(2-bromophenyl)-2-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]acetamide
CID 134064959
N-(2-bromophenyl)-2-quinolin-6-yloxyacetamide
CID 112978725
N-(2-bromophenyl)-2-(4-phenylphenoxy)acetamide
CID 1193865
N-(2-bromophenyl)-2-[[6-(methylaminomethyl)-3-pyridinyl]oxy]acetamide
CID 79781844
5-[2-(2-bromoanilino)-2-oxoethoxy]pyridine-3-carboxylic acid
CID 63851160
N,N'-bis(2-bromophenyl)butanediamide
CID 1039657
N-(2-bromophenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2558535

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide?
The IUPAC name of N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide (CID 2096177) is N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide?
The canonical SMILES for N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide is O=C(COc1cnc2ccccc2n1)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide?
The InChIKey is NNKSINFRBCGJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12BrN3O2/c17-11-5-1-2-6-12(11)19-15(21)10-22-16-9-18-13-7-3-4-8-14(13)20-16/h1-9H,10H2,(H,19,21).
What are the key properties of N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide?
N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide has a molecular weight of 358.19 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide is sourced from PubChem (CID 2096177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).