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

C19H17N5O2 — CID 53186584

IUPAC5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
SMILESCCn1c(=O)c2ccnn2c2ccc(C(=O)NCc3ccncc3)cc21
InChIInChI=1S/C19H17N5O2/c1-2-23-17-11-14(18(25)21-12-13-5-8-20-9-6-13)3-4-15(17)24-16(19(23)26)7-10-22-24/h3-11H,2,12H2,1H3,(H,21,25)
InChIKeyNOQRQMGRHJZUFW-UHFFFAOYSA-N
MW347.38 g/mol
LogP1.99
Rot. Bonds4

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

5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide (PubChem CID 53186584) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide.

Molecular Properties

Compound Name5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
PubChem CID53186584
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Name5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide
SMILESCCn1c(=O)c2ccnn2c2ccc(C(=O)NCc3ccncc3)cc21
InChIInChI=1S/C19H17N5O2/c1-2-23-17-11-14(18(25)21-12-13-5-8-20-9-6-13)3-4-15(17)24-16(19(23)26)7-10-22-24/h3-11H,2,12H2,1H3,(H,21,25)
InChIKeyNOQRQMGRHJZUFW-UHFFFAOYSA-N
XLogP1.99
TPSA81.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The IUPAC name of 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide (CID 53186584) is 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide.
What is the SMILES notation for 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The canonical SMILES for 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide is CCn1c(=O)c2ccnn2c2ccc(C(=O)NCc3ccncc3)cc21.
What is the InChIKey of 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
The InChIKey is NOQRQMGRHJZUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-2-23-17-11-14(18(25)21-12-13-5-8-20-9-6-13)3-4-15(17)24-16(19(23)26)7-10-22-24/h3-11H,2,12H2,1H3,(H,21,25).
What are the key properties of 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide?
5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide has a molecular weight of 347.38 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-oxo-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]quinoxaline-7-carboxamide is sourced from PubChem (CID 53186584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).