5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol

C11H7FN4O — CID 175505312

IUPAC5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol
SMILESOc1ccc2ncc(-c3cn[nH]c3)nc2c1F
InChIInChI=1S/C11H7FN4O/c12-10-9(17)2-1-7-11(10)16-8(5-13-7)6-3-14-15-4-6/h1-5,17H,(H,14,15)
InChIKeyKYQNDUYNJCGGDU-UHFFFAOYSA-N
MW230.20 g/mol
LogP1.86
Rot. Bonds1

About 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol

5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol (PubChem CID 175505312) has the molecular formula C11H7FN4O and a molecular weight of 230.20 g/mol. Its IUPAC name is 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol.

Molecular Properties

Compound Name5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol
PubChem CID175505312
Molecular FormulaC11H7FN4O
Molecular Weight230.20 g/mol
Exact Mass230.06
IUPAC Name5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol
SMILESOc1ccc2ncc(-c3cn[nH]c3)nc2c1F
InChIInChI=1S/C11H7FN4O/c12-10-9(17)2-1-7-11(10)16-8(5-13-7)6-3-14-15-4-6/h1-5,17H,(H,14,15)
InChIKeyKYQNDUYNJCGGDU-UHFFFAOYSA-N
XLogP1.86
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol?
The IUPAC name of 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol (CID 175505312) is 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol.
What is the SMILES notation for 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol?
The canonical SMILES for 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol is Oc1ccc2ncc(-c3cn[nH]c3)nc2c1F.
What is the InChIKey of 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol?
The InChIKey is KYQNDUYNJCGGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7FN4O/c12-10-9(17)2-1-7-11(10)16-8(5-13-7)6-3-14-15-4-6/h1-5,17H,(H,14,15).
What are the key properties of 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol?
5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol has a molecular weight of 230.20 g/mol, XLogP of 1.86, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-(1H-pyrazol-4-yl)quinoxalin-6-ol is sourced from PubChem (CID 175505312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).