4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline

C15H10N2S — CID 146169494

IUPAC4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline
SMILESc1csc(-c2nc3ccccc3n3cccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-6-12-11(5-1)16-15(14-8-4-10-18-14)13-7-3-9-17(12)13/h1-10H
InChIKeyWDDCACQLRBYZQM-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.22
Rot. Bonds1

About 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline

4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline (PubChem CID 146169494) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline
PubChem CID146169494
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline
SMILESc1csc(-c2nc3ccccc3n3cccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-6-12-11(5-1)16-15(14-8-4-10-18-14)13-7-3-9-17(12)13/h1-10H
InChIKeyWDDCACQLRBYZQM-UHFFFAOYSA-N
XLogP4.22
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline?
The IUPAC name of 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline (CID 146169494) is 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline.
What is the SMILES notation for 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline?
The canonical SMILES for 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline is c1csc(-c2nc3ccccc3n3cccc23)c1.
What is the InChIKey of 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline?
The InChIKey is WDDCACQLRBYZQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-2-6-12-11(5-1)16-15(14-8-4-10-18-14)13-7-3-9-17(12)13/h1-10H.
What are the key properties of 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline?
4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline has a molecular weight of 250.33 g/mol, XLogP of 4.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thiophen-2-ylpyrrolo[1,2-a]quinoxaline is sourced from PubChem (CID 146169494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).