1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one

C16H15N3O — CID 658225

IUPAC1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one
SMILESCNc1ccccc1-c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C16H15N3O/c1-17-12-8-4-3-7-11(12)15-16(20)19(2)14-10-6-5-9-13(14)18-15/h3-10,17H,1-2H3
InChIKeyOMIWXYUXARPHEI-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.64
Rot. Bonds2

About 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one

1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one (PubChem CID 658225) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one.

Molecular Properties

Compound Name1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one
PubChem CID658225
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one
SMILESCNc1ccccc1-c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C16H15N3O/c1-17-12-8-4-3-7-11(12)15-16(20)19(2)14-10-6-5-9-13(14)18-15/h3-10,17H,1-2H3
InChIKeyOMIWXYUXARPHEI-UHFFFAOYSA-N
XLogP2.64
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one?
The IUPAC name of 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one (CID 658225) is 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one.
What is the SMILES notation for 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one?
The canonical SMILES for 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one is CNc1ccccc1-c1nc2ccccc2n(C)c1=O.
What is the InChIKey of 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one?
The InChIKey is OMIWXYUXARPHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-17-12-8-4-3-7-11(12)15-16(20)19(2)14-10-6-5-9-13(14)18-15/h3-10,17H,1-2H3.
What are the key properties of 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one?
1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one has a molecular weight of 265.32 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[2-(methylamino)phenyl]quinoxalin-2-one is sourced from PubChem (CID 658225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).