1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one

C13H14N4O — CID 15807359

IUPAC1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one
SMILESCN1C(=O)C(c2ccnn2C)Nc2ccccc21
InChIInChI=1S/C13H14N4O/c1-16-10-6-4-3-5-9(10)15-12(13(16)18)11-7-8-14-17(11)2/h3-8,12,15H,1-2H3
InChIKeyMACIWFJNDXPOOQ-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.55
Rot. Bonds1

About 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one

1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one (PubChem CID 15807359) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one
PubChem CID15807359
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one
SMILESCN1C(=O)C(c2ccnn2C)Nc2ccccc21
InChIInChI=1S/C13H14N4O/c1-16-10-6-4-3-5-9(10)15-12(13(16)18)11-7-8-14-17(11)2/h3-8,12,15H,1-2H3
InChIKeyMACIWFJNDXPOOQ-UHFFFAOYSA-N
XLogP1.55
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-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 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one (CID 15807359) is 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one is CN1C(=O)C(c2ccnn2C)Nc2ccccc21.
What is the InChIKey of 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one?
The InChIKey is MACIWFJNDXPOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-16-10-6-4-3-5-9(10)15-12(13(16)18)11-7-8-14-17(11)2/h3-8,12,15H,1-2H3.
What are the key properties of 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one?
1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one has a molecular weight of 242.28 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methylpyrazol-3-yl)-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 15807359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).