N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide

C15H11N5OS — CID 18999892

IUPACN-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide
SMILESCC(=O)Nn1ncc2cc3ncc(-c4ccsc4)nc3cc21
InChIInChI=1S/C15H11N5OS/c1-9(21)19-20-15-5-13-12(4-11(15)6-17-20)16-7-14(18-13)10-2-3-22-8-10/h2-8H,1H3,(H,19,21)
InChIKeyLARLZTYOKZIDHX-UHFFFAOYSA-N
MW309.35 g/mol
LogP2.80
Rot. Bonds2

About N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide

N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide (PubChem CID 18999892) has the molecular formula C15H11N5OS and a molecular weight of 309.35 g/mol. Its IUPAC name is N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide
PubChem CID18999892
Molecular FormulaC15H11N5OS
Molecular Weight309.35 g/mol
Exact Mass309.07
IUPAC NameN-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide
SMILESCC(=O)Nn1ncc2cc3ncc(-c4ccsc4)nc3cc21
InChIInChI=1S/C15H11N5OS/c1-9(21)19-20-15-5-13-12(4-11(15)6-17-20)16-7-14(18-13)10-2-3-22-8-10/h2-8H,1H3,(H,19,21)
InChIKeyLARLZTYOKZIDHX-UHFFFAOYSA-N
XLogP2.80
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.35
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide?
The IUPAC name of N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide (CID 18999892) is N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide.
What is the SMILES notation for N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide?
The canonical SMILES for N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide is CC(=O)Nn1ncc2cc3ncc(-c4ccsc4)nc3cc21.
What is the InChIKey of N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide?
The InChIKey is LARLZTYOKZIDHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5OS/c1-9(21)19-20-15-5-13-12(4-11(15)6-17-20)16-7-14(18-13)10-2-3-22-8-10/h2-8H,1H3,(H,19,21).
What are the key properties of N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide?
N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide has a molecular weight of 309.35 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-1-yl)acetamide is sourced from PubChem (CID 18999892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).