N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide

C20H22N4O2 — CID 46365308

IUPACN-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide
SMILESCCCNc1nc2ccccc2nc1C(=O)Nc1ccccc1OCC
InChIInChI=1S/C20H22N4O2/c1-3-13-21-19-18(22-14-9-5-6-10-15(14)23-19)20(25)24-16-11-7-8-12-17(16)26-4-2/h5-12H,3-4,13H2,1-2H3,(H,21,23)(H,24,25)
InChIKeyVTGWITFSNZJSNR-UHFFFAOYSA-N
MW350.42 g/mol
LogP4.10
Rot. Bonds7

About N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide

N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide (PubChem CID 46365308) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide
PubChem CID46365308
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC NameN-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide
SMILESCCCNc1nc2ccccc2nc1C(=O)Nc1ccccc1OCC
InChIInChI=1S/C20H22N4O2/c1-3-13-21-19-18(22-14-9-5-6-10-15(14)23-19)20(25)24-16-11-7-8-12-17(16)26-4-2/h5-12H,3-4,13H2,1-2H3,(H,21,23)(H,24,25)
InChIKeyVTGWITFSNZJSNR-UHFFFAOYSA-N
XLogP4.10
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201237
N-(2-ethoxyphenyl)-3-hydroxypyridine-2-carboxamide
CID 54860891
N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 110650287
4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 30843274
N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
CID 16866355
3,4,5-triethoxy-N-(2-propoxyphenyl)benzamide
CID 7941942
6-N-(2-ethoxyphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100070
6-N-(2-chlorophenyl)-2-N-(2-ethoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100812
N-(2-ethoxyphenyl)-2-(3-methoxypropylamino)pyrimidine-4-carboxamide
CID 109300089
N-(2,5-diethoxyphenyl)-3-(diethylamino)quinoxaline-2-carboxamide
CID 46365153
N-(2-ethoxyphenyl)-2-iodobenzamide
CID 996130
N-(2-ethoxyphenyl)-4-formylbenzamide
CID 134025431

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide (CID 46365308) is N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide is CCCNc1nc2ccccc2nc1C(=O)Nc1ccccc1OCC.
What is the InChIKey of N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide?
The InChIKey is VTGWITFSNZJSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-3-13-21-19-18(22-14-9-5-6-10-15(14)23-19)20(25)24-16-11-7-8-12-17(16)26-4-2/h5-12H,3-4,13H2,1-2H3,(H,21,23)(H,24,25).
What are the key properties of N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide?
N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 4.10, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-3-(propylamino)quinoxaline-2-carboxamide is sourced from PubChem (CID 46365308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).