1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one

C20H19N3O2 — CID 42885478

IUPAC1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one
SMILESCC1CCc2ccccc2N1C(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C20H19N3O2/c1-14-10-11-15-6-2-4-8-17(15)23(14)20(25)13-22-18-9-5-3-7-16(18)21-12-19(22)24/h2-9,12,14H,10-11,13H2,1H3
InChIKeyZBTRWYQNBODVBW-UHFFFAOYSA-N
MW333.39 g/mol
LogP2.76
Rot. Bonds2

About 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one

1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one (PubChem CID 42885478) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one.

Molecular Properties

Compound Name1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one
PubChem CID42885478
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one
SMILESCC1CCc2ccccc2N1C(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C20H19N3O2/c1-14-10-11-15-6-2-4-8-17(15)23(14)20(25)13-22-18-9-5-3-7-16(18)21-12-19(22)24/h2-9,12,14H,10-11,13H2,1H3
InChIKeyZBTRWYQNBODVBW-UHFFFAOYSA-N
XLogP2.76
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one with MolForge

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Related Compounds

1-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]quinoxalin-2-one
CID 2425815
1-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-[2-(1,3-thiazol-4-yl)benzimidazol-1-yl]ethanone
CID 41022826
1-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]quinoxalin-2-one
CID 8851893
1-[2-[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]quinoxalin-2-one
CID 55868759
1-[2-[(2R,3aR,7aR)-2-methyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-2-oxoethyl]quinoxalin-2-one
CID 124740313
5-fluoro-1-[2-[(2R)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-2-oxoethyl]pyridin-2-one
CID 99831437
2-(benzimidazol-1-yl)-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 3408153
3-chloro-1-[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]propan-1-one
CID 36690377
1-[2-[4-(cyclopropylmethyl)piperazin-1-yl]-2-oxoethyl]quinoxalin-2-one
CID 56816771
1-[3-[(2S)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]cinnolin-4-one
CID 9488517
4-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-7H-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-dione
CID 167845655
1-(2-morpholin-4-yl-2-oxoethyl)quinoxalin-2-one
CID 8892399

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one?
The IUPAC name of 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one (CID 42885478) is 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one.
What is the SMILES notation for 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one?
The canonical SMILES for 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one is CC1CCc2ccccc2N1C(=O)Cn1c(=O)cnc2ccccc21.
What is the InChIKey of 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one?
The InChIKey is ZBTRWYQNBODVBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-14-10-11-15-6-2-4-8-17(15)23(14)20(25)13-22-18-9-5-3-7-16(18)21-12-19(22)24/h2-9,12,14H,10-11,13H2,1H3.
What are the key properties of 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one?
1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one has a molecular weight of 333.39 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]quinoxalin-2-one is sourced from PubChem (CID 42885478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).