1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol

C15H12N4OS — CID 18999837

IUPAC1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol
SMILESCC(O)n1cc2cc3ncc(-c4ccsc4)nc3cc2n1
InChIInChI=1S/C15H12N4OS/c1-9(20)19-7-11-4-13-14(5-12(11)18-19)17-15(6-16-13)10-2-3-21-8-10/h2-9,20H,1H3
InChIKeyCNFJQCGXZRVSAZ-UHFFFAOYSA-N
MW296.36 g/mol
LogP3.22
Rot. Bonds2

About 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol

1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol (PubChem CID 18999837) has the molecular formula C15H12N4OS and a molecular weight of 296.36 g/mol. Its IUPAC name is 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol.

Molecular Properties

Compound Name1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol
PubChem CID18999837
Molecular FormulaC15H12N4OS
Molecular Weight296.36 g/mol
Exact Mass296.07
IUPAC Name1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol
SMILESCC(O)n1cc2cc3ncc(-c4ccsc4)nc3cc2n1
InChIInChI=1S/C15H12N4OS/c1-9(20)19-7-11-4-13-14(5-12(11)18-19)17-15(6-16-13)10-2-3-21-8-10/h2-9,20H,1H3
InChIKeyCNFJQCGXZRVSAZ-UHFFFAOYSA-N
XLogP3.22
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Triazolo[4,5-h]quinolin-1-ylmethanol
CID 12026627
Triazolo[4,5-f]quinolin-2-ylmethanol
CID 21858081
6-(5-chlorothiophen-2-yl)-1H-pyrazolo[3,4-g]quinoxaline
CID 15814131
7-(5-chlorothien-2-yl)-1H-pyrazolo[3,4-g]quinoxaline
CID 15814132
6-thienyl-1H-pyrazolo[3,4-g]quinoxaline
CID 18999799
7-(phenylsulfanylmethyl)-1H-pyrazolo[4,3-g]quinoxaline
CID 18999803
7-(5-Chlorothiophen-2-yl)-2-methylpyrazolo[4,3-g]quinoxaline
CID 18999804
7-thienyl-1H-pyrazolo[3,4-g]quinoxaline
CID 18999807
N-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)acetamide
CID 18999840
2-(2-Methoxyethyl)-7-thiophen-3-ylpyrazolo[4,3-g]quinoxaline
CID 18999843
1-Methyl-7-thiophen-3-ylpyrazolo[4,3-g]quinoxaline
CID 18999862
1-(2-Methoxyethyl)-7-thiophen-3-ylpyrazolo[4,3-g]quinoxaline
CID 18999865

Frequently Asked Questions

What is the IUPAC name of 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol?
The IUPAC name of 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol (CID 18999837) is 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol.
What is the SMILES notation for 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol?
The canonical SMILES for 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol is CC(O)n1cc2cc3ncc(-c4ccsc4)nc3cc2n1.
What is the InChIKey of 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol?
The InChIKey is CNFJQCGXZRVSAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4OS/c1-9(20)19-7-11-4-13-14(5-12(11)18-19)17-15(6-16-13)10-2-3-21-8-10/h2-9,20H,1H3.
What are the key properties of 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol?
1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol has a molecular weight of 296.36 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-thiophen-3-ylpyrazolo[4,3-g]quinoxalin-2-yl)ethanol is sourced from PubChem (CID 18999837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).