2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone

C15H20N2O2 — CID 104750805

IUPAC2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone
SMILESCN1CCN(CC(=O)C2CCOC2)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-16-7-8-17(14-5-3-2-4-13(14)16)10-15(18)12-6-9-19-11-12/h2-5,12H,6-11H2,1H3
InChIKeyRWENNJKNPQQWRQ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.55
Rot. Bonds3

About 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone

2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone (PubChem CID 104750805) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone.

Molecular Properties

Compound Name2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone
PubChem CID104750805
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone
SMILESCN1CCN(CC(=O)C2CCOC2)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-16-7-8-17(14-5-3-2-4-13(14)16)10-15(18)12-6-9-19-11-12/h2-5,12H,6-11H2,1H3
InChIKeyRWENNJKNPQQWRQ-UHFFFAOYSA-N
XLogP1.55
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-[2-oxo-2-(oxolan-3-yl)ethyl]-4H-quinazolin-2-one
CID 104751611
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanamine
CID 104746378
2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(oxolan-3-yl)ethanone
CID 104750092
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-phenylethanone
CID 63776591
1-[2-oxo-2-(oxolan-3-yl)ethyl]-4-propylpiperazine-2,5-dione
CID 113448958
1-(oxolan-3-yl)-2-(4-phenylpiperazin-1-yl)ethanone
CID 104749860
N-ethyl-3-[(4-methyl-2,3-dihydroquinoxalin-1-yl)methyl]oxan-4-amine
CID 103060215
1-cyclopropyl-2-(2,3-dihydroindol-1-yl)ethanone
CID 63912554
1-(3-bromophenyl)-2-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanone
CID 63777499
1-(oxolan-3-yl)-2-(4-propylpiperazin-1-yl)ethanone
CID 104749907
1-(oxolan-3-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 103498923
4,4-dimethyl-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)pentan-3-one
CID 63778227

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone?
The IUPAC name of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone (CID 104750805) is 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone.
What is the SMILES notation for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone?
The canonical SMILES for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone is CN1CCN(CC(=O)C2CCOC2)c2ccccc21.
What is the InChIKey of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone?
The InChIKey is RWENNJKNPQQWRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-16-7-8-17(14-5-3-2-4-13(14)16)10-15(18)12-6-9-19-11-12/h2-5,12H,6-11H2,1H3.
What are the key properties of 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone?
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone has a molecular weight of 260.34 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanone is sourced from PubChem (CID 104750805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).