N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide

C17H12N4O2 — CID 3903681

IUPACN-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
SMILESN#Cc1ccc(NC(=O)COc2ccc3nccnc3c2)cc1
InChIInChI=1S/C17H12N4O2/c18-10-12-1-3-13(4-2-12)21-17(22)11-23-14-5-6-15-16(9-14)20-8-7-19-15/h1-9H,11H2,(H,21,22)
InChIKeyRJNJYUYAAWWHGI-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.52
Rot. Bonds4

About N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide

N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide (PubChem CID 3903681) has the molecular formula C17H12N4O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
PubChem CID3903681
Molecular FormulaC17H12N4O2
Molecular Weight304.31 g/mol
Exact Mass304.10
IUPAC NameN-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
SMILESN#Cc1ccc(NC(=O)COc2ccc3nccnc3c2)cc1
InChIInChI=1S/C17H12N4O2/c18-10-12-1-3-13(4-2-12)21-17(22)11-23-14-5-6-15-16(9-14)20-8-7-19-15/h1-9H,11H2,(H,21,22)
InChIKeyRJNJYUYAAWWHGI-UHFFFAOYSA-N
XLogP2.52
TPSA87.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7966728
N-(4-cyanophenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61027849
N-(4-bromophenyl)-2-(4-cyanophenoxy)acetamide
CID 7818711
N-(4-cyanophenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)acetamide
CID 112978228
2-[4-(cyanomethyl)phenoxy]-N-(4-cyanophenyl)acetamide
CID 43824284
N-(4-bromophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 3473577
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
2-(4-cyanophenoxy)-N-pyridin-3-ylacetamide
CID 24707250
2-(4-cyanophenoxy)-N-(3-hydroxy-4-methanimidoylphenyl)acetamide
CID 142003500
ethyl 4-[2-(4-cyanoanilino)-2-oxoethoxy]benzoate
CID 34569577
methyl 4-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]benzoate
CID 1034299
[2-(4-cyanoanilino)-2-oxoethyl] 2-(3,4-dimethylphenoxy)acetate
CID 8923798

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide?
The IUPAC name of N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide (CID 3903681) is N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide is N#Cc1ccc(NC(=O)COc2ccc3nccnc3c2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide?
The InChIKey is RJNJYUYAAWWHGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O2/c18-10-12-1-3-13(4-2-12)21-17(22)11-23-14-5-6-15-16(9-14)20-8-7-19-15/h1-9H,11H2,(H,21,22).
What are the key properties of N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide?
N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide has a molecular weight of 304.31 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide is sourced from PubChem (CID 3903681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).