8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one

C24H32N4O — CID 70692632

IUPAC8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one
SMILESCCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)n(C)c12
InChIInChI=1S/C24H32N4O/c1-7-12-28(13-8-2)20-11-9-10-19-22(20)27(6)24(29)23(25-19)26-21-17(4)14-16(3)15-18(21)5/h9-11,14-15H,7-8,12-13H2,1-6H3,(H,25,26)
InChIKeyFNKFMDRKLZSFGN-UHFFFAOYSA-N
MW392.55 g/mol
LogP5.23
Rot. Bonds7

About 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one

8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one (PubChem CID 70692632) has the molecular formula C24H32N4O and a molecular weight of 392.55 g/mol. Its IUPAC name is 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one.

Molecular Properties

Compound Name8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one
PubChem CID70692632
Molecular FormulaC24H32N4O
Molecular Weight392.55 g/mol
Exact Mass392.26
IUPAC Name8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one
SMILESCCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)n(C)c12
InChIInChI=1S/C24H32N4O/c1-7-12-28(13-8-2)20-11-9-10-19-22(20)27(6)24(29)23(25-19)26-21-17(4)14-16(3)15-18(21)5/h9-11,14-15H,7-8,12-13H2,1-6H3,(H,25,26)
InChIKeyFNKFMDRKLZSFGN-UHFFFAOYSA-N
XLogP5.23
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.55
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one?
The IUPAC name of 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one (CID 70692632) is 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one.
What is the SMILES notation for 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one?
The canonical SMILES for 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one is CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)c(=O)n(C)c12.
What is the InChIKey of 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one?
The InChIKey is FNKFMDRKLZSFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N4O/c1-7-12-28(13-8-2)20-11-9-10-19-22(20)27(6)24(29)23(25-19)26-21-17(4)14-16(3)15-18(21)5/h9-11,14-15H,7-8,12-13H2,1-6H3,(H,25,26).
What are the key properties of 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one?
8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one has a molecular weight of 392.55 g/mol, XLogP of 5.23, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(dipropylamino)-1-methyl-3-(2,4,6-trimethylanilino)quinoxalin-2-one is sourced from PubChem (CID 70692632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).