8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide

C20H19N7O3 — CID 169095148

IUPAC8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
SMILESCCn1c(=O)c2ccnn2c2cc(NC(C)=O)c(C(=O)NCc3cncnc3)cc21
InChIInChI=1S/C20H19N7O3/c1-3-26-17-6-14(19(29)23-10-13-8-21-11-22-9-13)15(25-12(2)28)7-18(17)27-16(20(26)30)4-5-24-27/h4-9,11H,3,10H2,1-2H3,(H,23,29)(H,25,28)
InChIKeyOVENXINRYODYBV-UHFFFAOYSA-N
MW405.42 g/mol
LogP1.35
Rot. Bonds5

About 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide

8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide (PubChem CID 169095148) has the molecular formula C20H19N7O3 and a molecular weight of 405.42 g/mol. Its IUPAC name is 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide.

Molecular Properties

Compound Name8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
PubChem CID169095148
Molecular FormulaC20H19N7O3
Molecular Weight405.42 g/mol
Exact Mass405.15
IUPAC Name8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
SMILESCCn1c(=O)c2ccnn2c2cc(NC(C)=O)c(C(=O)NCc3cncnc3)cc21
InChIInChI=1S/C20H19N7O3/c1-3-26-17-6-14(19(29)23-10-13-8-21-11-22-9-13)15(25-12(2)28)7-18(17)27-16(20(26)30)4-5-24-27/h4-9,11H,3,10H2,1-2H3,(H,23,29)(H,25,28)
InChIKeyOVENXINRYODYBV-UHFFFAOYSA-N
XLogP1.35
TPSA123.28 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.42
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide 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

5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186584
5-ethyl-N-[(6-methyl-3-pyridinyl)methyl]-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 171345117
N-[(3-chlorophenyl)methyl]-5-ethyl-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186622
5-ethyl-N-methyl-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186577
5-ethyl-4-oxo-N-(2-pyridin-3-ylethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186625
5-ethyl-N-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186590
5-ethyl-N-(5-fluoro-2-methylphenyl)-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186610
5-[(4-methylsulfonylphenyl)methyl]-4-oxo-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 171352839
5-benzyl-N-(2-methoxyethyl)-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186672
5-[(3-methoxyphenyl)methyl]-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186706
5-benzyl-N-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 91903225
5-benzyl-4-oxo-N-(3-pyrazol-1-ylpropyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
CID 53186681

Frequently Asked Questions

What is the IUPAC name of 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The IUPAC name of 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide (CID 169095148) is 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide.
What is the SMILES notation for 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The canonical SMILES for 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide is CCn1c(=O)c2ccnn2c2cc(NC(C)=O)c(C(=O)NCc3cncnc3)cc21.
What is the InChIKey of 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The InChIKey is OVENXINRYODYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O3/c1-3-26-17-6-14(19(29)23-10-13-8-21-11-22-9-13)15(25-12(2)28)7-18(17)27-16(20(26)30)4-5-24-27/h4-9,11H,3,10H2,1-2H3,(H,23,29)(H,25,28).
What are the key properties of 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide has a molecular weight of 405.42 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-acetamido-5-ethyl-4-oxo-N-(pyrimidin-5-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide is sourced from PubChem (CID 169095148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).