N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide

C20H22N4O3 — CID 17252034

IUPACN-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc2c(cc1N(C)C)n(C)c(=O)c(=O)n2C
InChIInChI=1S/C20H22N4O3/c1-12-8-6-7-9-13(12)18(25)21-14-10-16-17(11-15(14)22(2)3)24(5)20(27)19(26)23(16)4/h6-11H,1-5H3,(H,21,25)
InChIKeyRBCDCOUVJMNGON-UHFFFAOYSA-N
MW366.42 g/mol
LogP1.86
Rot. Bonds3

About N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide

N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide (PubChem CID 17252034) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide
PubChem CID17252034
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC NameN-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc2c(cc1N(C)C)n(C)c(=O)c(=O)n2C
InChIInChI=1S/C20H22N4O3/c1-12-8-6-7-9-13(12)18(25)21-14-10-16-17(11-15(14)22(2)3)24(5)20(27)19(26)23(16)4/h6-11H,1-5H3,(H,21,25)
InChIKeyRBCDCOUVJMNGON-UHFFFAOYSA-N
XLogP1.86
TPSA76.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(7-chloro-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl)-2-methylbenzamide
CID 46249057
2-methyl-N-(1,3,6-trimethyl-2-oxobenzimidazol-5-yl)benzamide
CID 46249111
2-chloro-N-[7-(diethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]benzamide
CID 50792040
N-[1,4-dimethyl-7-(4-methylpiperidin-1-yl)-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide
CID 50792225
4-tert-butyl-N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]benzamide
CID 17252033
N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-4-(trifluoromethyl)benzamide
CID 50792045
N-[7-(diethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methoxybenzamide
CID 50792211
N-[4-amino-2-chloro-5-(dimethylamino)phenyl]-2-methylbenzamide
CID 50881169
N-(6-butylsulfonyl-1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-methylbenzamide
CID 50824359
N-[2-(dimethylamino)phenyl]-4-hydroxy-2-methylbenzamide
CID 103863654
2-bromo-N-(1,4-dimethyl-2,3-dioxo-7-pyrrolidin-1-ylquinoxalin-6-yl)benzamide
CID 50791980
N-(2-bromo-4,5-dimethylphenyl)-2-methylbenzamide
CID 1233587

Frequently Asked Questions

What is the IUPAC name of N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide?
The IUPAC name of N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide (CID 17252034) is N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide.
What is the SMILES notation for N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide?
The canonical SMILES for N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide is Cc1ccccc1C(=O)Nc1cc2c(cc1N(C)C)n(C)c(=O)c(=O)n2C.
What is the InChIKey of N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide?
The InChIKey is RBCDCOUVJMNGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-12-8-6-7-9-13(12)18(25)21-14-10-16-17(11-15(14)22(2)3)24(5)20(27)19(26)23(16)4/h6-11H,1-5H3,(H,21,25).
What are the key properties of N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide?
N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide has a molecular weight of 366.42 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(dimethylamino)-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl]-2-methylbenzamide is sourced from PubChem (CID 17252034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).