N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide

C24H21N3O3 — CID 46976106

IUPACN-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCCOc1ccccc1-c1ccccc1NC(=O)c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C24H21N3O3/c1-3-30-21-15-9-5-11-17(21)16-10-4-6-12-18(16)26-23(28)22-24(29)27(2)20-14-8-7-13-19(20)25-22/h4-15H,3H2,1-2H3,(H,26,28)
InChIKeyUAXGPRYEASSOBL-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.25
Rot. Bonds5

About N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide

N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide (PubChem CID 46976106) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
PubChem CID46976106
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCCOc1ccccc1-c1ccccc1NC(=O)c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C24H21N3O3/c1-3-30-21-15-9-5-11-17(21)16-10-4-6-12-18(16)26-23(28)22-24(29)27(2)20-14-8-7-13-19(20)25-22/h4-15H,3H2,1-2H3,(H,26,28)
InChIKeyUAXGPRYEASSOBL-UHFFFAOYSA-N
XLogP4.25
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-3-oxo-N-pyridin-2-ylquinoxaline-2-carboxamide
CID 53009406
N-[(4-ethoxy-3-methoxyphenyl)methyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46364977
N-(2,5-dimethoxyphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46364976
N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46365046
N-[2-[2-(dimethylamino)ethoxy]-5-methylphenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46976122
N-(2,6-dimethylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46365020
N-(2-ethoxyphenyl)-3-methyl-4-oxophthalazine-1-carboxamide
CID 2591019
N-(2-ethoxyphenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylpropanamide
CID 46674723
N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide
CID 46365308
4-ethyl-N-(4-methylphenyl)-3-oxoquinoxaline-2-carboxamide
CID 46249419
N-(2-ethoxyphenyl)-3-hydroxypyridine-2-carboxamide
CID 54860891
4-ethyl-N-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxamide
CID 50808114

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide?
The IUPAC name of N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide (CID 46976106) is N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide.
What is the SMILES notation for N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide?
The canonical SMILES for N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide is CCOc1ccccc1-c1ccccc1NC(=O)c1nc2ccccc2n(C)c1=O.
What is the InChIKey of N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide?
The InChIKey is UAXGPRYEASSOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-3-30-21-15-9-5-11-17(21)16-10-4-6-12-18(16)26-23(28)22-24(29)27(2)20-14-8-7-13-19(20)25-22/h4-15H,3H2,1-2H3,(H,26,28).
What are the key properties of N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide?
N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide has a molecular weight of 399.45 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide is sourced from PubChem (CID 46976106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).