3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide

C19H19N3O2 — CID 50780048

IUPAC3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide
SMILESCOc1nc2cc(C)c(C)cc2nc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C19H19N3O2/c1-11-5-7-14(8-6-11)20-18(23)17-19(24-4)22-16-10-13(3)12(2)9-15(16)21-17/h5-10H,1-4H3,(H,20,23)
InChIKeyNFDXMARYUYHAAE-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.82
Rot. Bonds3

About 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide

3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide (PubChem CID 50780048) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide
PubChem CID50780048
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide
SMILESCOc1nc2cc(C)c(C)cc2nc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C19H19N3O2/c1-11-5-7-14(8-6-11)20-18(23)17-19(24-4)22-16-10-13(3)12(2)9-15(16)21-17/h5-10H,1-4H3,(H,20,23)
InChIKeyNFDXMARYUYHAAE-UHFFFAOYSA-N
XLogP3.82
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-6,7-dimethyl-N-(4-propan-2-ylphenyl)quinoxaline-2-carboxamide
CID 50779903
N-(3-chloro-4-methylphenyl)-3-methoxy-6,7-dimethylquinoxaline-2-carboxamide
CID 50780090
N-[4-(4-chlorophenoxy)phenyl]-3-methoxy-6,7-dimethylquinoxaline-2-carboxamide
CID 50780071
N-(4-bromo-3-methylphenyl)-3-methoxyquinoxaline-2-carboxamide
CID 50780732
N-(4-ethylphenyl)-6,7-dimethyl-3-propoxyquinoxaline-2-carboxamide
CID 50779889
N-(4-ethoxyphenyl)-6,7-dimethyl-3-propan-2-yloxyquinoxaline-2-carboxamide
CID 50779957
N-[4-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]phenyl]-3-methoxy-6,7-dimethylquinoxaline-2-carboxamide
CID 22917108
N-(3-chloro-4-methylphenyl)-6,7-dimethyl-3-propoxyquinoxaline-2-carboxamide
CID 50779973
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
3-ethoxy-N-(3-ethylphenyl)-6,7-dimethylquinoxaline-2-carboxamide
CID 50779971
N-(3-acetylphenyl)-3-ethoxy-6,7-dimethylquinoxaline-2-carboxamide
CID 50780095
3,5-dimethoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 2092676

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide?
The IUPAC name of 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide (CID 50780048) is 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide.
What is the SMILES notation for 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide?
The canonical SMILES for 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide is COc1nc2cc(C)c(C)cc2nc1C(=O)Nc1ccc(C)cc1.
What is the InChIKey of 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide?
The InChIKey is NFDXMARYUYHAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-11-5-7-14(8-6-11)20-18(23)17-19(24-4)22-16-10-13(3)12(2)9-15(16)21-17/h5-10H,1-4H3,(H,20,23).
What are the key properties of 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide?
3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6,7-dimethyl-N-(4-methylphenyl)quinoxaline-2-carboxamide is sourced from PubChem (CID 50780048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).