2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide

C18H21N3O — CID 83510562

IUPAC2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN1CCNc2ccccc21)c1ccccc1
InChIInChI=1S/C18H21N3O/c1-2-21(15-8-4-3-5-9-15)18(22)14-20-13-12-19-16-10-6-7-11-17(16)20/h3-11,19H,2,12-14H2,1H3
InChIKeyUDIKHRLOUZGSFE-UHFFFAOYSA-N
MW295.39 g/mol
LogP2.97
Rot. Bonds4

About 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide

2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide (PubChem CID 83510562) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide
PubChem CID83510562
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN1CCNc2ccccc21)c1ccccc1
InChIInChI=1S/C18H21N3O/c1-2-21(15-8-4-3-5-9-15)18(22)14-20-13-12-19-16-10-6-7-11-17(16)20/h3-11,19H,2,12-14H2,1H3
InChIKeyUDIKHRLOUZGSFE-UHFFFAOYSA-N
XLogP2.97
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2,3-dihydro-1H-quinoxaline
CID 3056887
2-(2,3-dihydro-1H-indol-3-yl)-N-ethyl-N-phenylacetamide
CID 80572173
N-ethyl-2-oxo-N-phenylimidazolidine-1-carboxamide
CID 2019740
N-ethyl-2-(2-methylpiperazin-1-yl)-N-phenylacetamide;hydrochloride
CID 119916315
N-ethyl-2-(1-methylpiperidin-4-yl)-N-phenylacetamide
CID 110754675
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
4-[(4-methylphenyl)methyl]-2,3-dihydro-1H-quinoxaline
CID 60811841
2-[(3S)-3-aminopyrrolidin-1-yl]-N-ethyl-N-phenylacetamide;hydrochloride
CID 119933615
4-(2,2-difluoroethyl)-2,3-dihydro-1H-quinoxaline
CID 60922941
1-benzyl-3,4-dihydro-2H-quinoxaline-6-carboxylic acid
CID 117006991
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-N-phenylacetamide
CID 79607499
N,N-diethyl-2-(5-hydroxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)acetamide
CID 104558270

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide?
The IUPAC name of 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide (CID 83510562) is 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide.
What is the SMILES notation for 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide?
The canonical SMILES for 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide is CCN(C(=O)CN1CCNc2ccccc21)c1ccccc1.
What is the InChIKey of 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide?
The InChIKey is UDIKHRLOUZGSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-2-21(15-8-4-3-5-9-15)18(22)14-20-13-12-19-16-10-6-7-11-17(16)20/h3-11,19H,2,12-14H2,1H3.
What are the key properties of 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide?
2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide has a molecular weight of 295.39 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-quinoxalin-1-yl)-N-ethyl-N-phenylacetamide is sourced from PubChem (CID 83510562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).