6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline

C15H9FN4 — CID 18999913

IUPAC6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline
SMILESFc1cccc(-c2cnc3cc4[nH]ncc4cc3n2)c1
InChIInChI=1S/C15H9FN4/c16-11-3-1-2-9(4-11)15-8-17-13-6-12-10(7-18-20-12)5-14(13)19-15/h1-8H,(H,18,20)
InChIKeyPRVBFDNUNRSTGL-UHFFFAOYSA-N
MW264.26 g/mol
LogP3.31
Rot. Bonds1

About 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline

6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline (PubChem CID 18999913) has the molecular formula C15H9FN4 and a molecular weight of 264.26 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline.

Molecular Properties

Compound Name6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline
PubChem CID18999913
Molecular FormulaC15H9FN4
Molecular Weight264.26 g/mol
Exact Mass264.08
IUPAC Name6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline
SMILESFc1cccc(-c2cnc3cc4[nH]ncc4cc3n2)c1
InChIInChI=1S/C15H9FN4/c16-11-3-1-2-9(4-11)15-8-17-13-6-12-10(7-18-20-12)5-14(13)19-15/h1-8H,(H,18,20)
InChIKeyPRVBFDNUNRSTGL-UHFFFAOYSA-N
XLogP3.31
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.26
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 162648239
4-(3-(5-fluoropyridin-2-yl)-1H-pyrazol-4-yl)quinoline
CID 11033585
5-(4-benzyl-1H-1,2,3-triazol-1-yl)-1H-indazole
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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline?
The IUPAC name of 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline (CID 18999913) is 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline.
What is the SMILES notation for 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline?
The canonical SMILES for 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline is Fc1cccc(-c2cnc3cc4[nH]ncc4cc3n2)c1.
What is the InChIKey of 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline?
The InChIKey is PRVBFDNUNRSTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9FN4/c16-11-3-1-2-9(4-11)15-8-17-13-6-12-10(7-18-20-12)5-14(13)19-15/h1-8H,(H,18,20).
What are the key properties of 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline?
6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline has a molecular weight of 264.26 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-1H-pyrazolo[3,4-g]quinoxaline is sourced from PubChem (CID 18999913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).