N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide

C21H20N4O4 — CID 53194313

IUPACN-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCCn1c(=O)c2cc(C(=O)Nc3ccc(OC)cc3OC)nn2c2ccccc21
InChIInChI=1S/C21H20N4O4/c1-4-24-16-7-5-6-8-17(16)25-18(21(24)27)12-15(23-25)20(26)22-14-10-9-13(28-2)11-19(14)29-3/h5-12H,4H2,1-3H3,(H,22,26)
InChIKeyPVGRYIQJCLVKPT-UHFFFAOYSA-N
MW392.42 g/mol
LogP2.94
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide

N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide (PubChem CID 53194313) has the molecular formula C21H20N4O4 and a molecular weight of 392.42 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
PubChem CID53194313
Molecular FormulaC21H20N4O4
Molecular Weight392.42 g/mol
Exact Mass392.15
IUPAC NameN-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCCn1c(=O)c2cc(C(=O)Nc3ccc(OC)cc3OC)nn2c2ccccc21
InChIInChI=1S/C21H20N4O4/c1-4-24-16-7-5-6-8-17(16)25-18(21(24)27)12-15(23-25)20(26)22-14-10-9-13(28-2)11-19(14)29-3/h5-12H,4H2,1-3H3,(H,22,26)
InChIKeyPVGRYIQJCLVKPT-UHFFFAOYSA-N
XLogP2.94
TPSA86.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.42
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2,4-dimethoxyphenyl)-5-methyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
CID 53194272
N-(2,4-dimethoxyphenyl)-3-(2-methoxyphenyl)-4-oxophthalazine-1-carboxamide
CID 3503219
N-(2,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619927
5-benzyl-N-(2,4-dimethoxyphenyl)-4-oxo-7,8-dihydro-6H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
CID 53086333
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
1-(2,4-dimethoxyphenyl)-3-[1-(4-ethyl-3-oxoquinoxalin-2-yl)piperidin-4-yl]urea
CID 46393118
N-(2,4-dimethoxyphenyl)-6-(N-ethylanilino)pyrimidine-4-carboxamide
CID 109357426
N-(2,4-dimethoxyphenyl)-4,6,7-trimethyl-3-oxoquinoxaline-2-carboxamide
CID 46249305
N-(2,4-dimethoxyphenyl)-5-ethyl-1-phenyltriazole-4-carboxamide
CID 91885850
N-(2,4-dimethoxyphenyl)-1-(2-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide
CID 50745726
N-(2,4-dimethoxyphenyl)-2,4-dioxo-3-(pyridin-2-ylmethyl)-1H-pyrimidine-5-carboxamide
CID 121026401
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide (CID 53194313) is N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide is CCn1c(=O)c2cc(C(=O)Nc3ccc(OC)cc3OC)nn2c2ccccc21.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
The InChIKey is PVGRYIQJCLVKPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O4/c1-4-24-16-7-5-6-8-17(16)25-18(21(24)27)12-15(23-25)20(26)22-14-10-9-13(28-2)11-19(14)29-3/h5-12H,4H2,1-3H3,(H,22,26).
What are the key properties of N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide?
N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide has a molecular weight of 392.42 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide is sourced from PubChem (CID 53194313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).