3-(1,1-difluoroethyl)quinoxalin-6-ol

C10H8F2N2O — CID 136602863

IUPAC3-(1,1-difluoroethyl)quinoxalin-6-ol
SMILESCC(F)(F)c1cnc2ccc(O)cc2n1
InChIInChI=1S/C10H8F2N2O/c1-10(11,12)9-5-13-7-3-2-6(15)4-8(7)14-9/h2-5,15H,1H3
InChIKeyGHMHYZGFWIYXAS-UHFFFAOYSA-N
MW210.18 g/mol
LogP2.45
Rot. Bonds1

About 3-(1,1-difluoroethyl)quinoxalin-6-ol

3-(1,1-difluoroethyl)quinoxalin-6-ol (PubChem CID 136602863) has the molecular formula C10H8F2N2O and a molecular weight of 210.18 g/mol. Its IUPAC name is 3-(1,1-difluoroethyl)quinoxalin-6-ol.

Molecular Properties

Compound Name3-(1,1-difluoroethyl)quinoxalin-6-ol
PubChem CID136602863
Molecular FormulaC10H8F2N2O
Molecular Weight210.18 g/mol
Exact Mass210.06
IUPAC Name3-(1,1-difluoroethyl)quinoxalin-6-ol
SMILESCC(F)(F)c1cnc2ccc(O)cc2n1
InChIInChI=1S/C10H8F2N2O/c1-10(11,12)9-5-13-7-3-2-6(15)4-8(7)14-9/h2-5,15H,1H3
InChIKeyGHMHYZGFWIYXAS-UHFFFAOYSA-N
XLogP2.45
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1,1-difluoroethyl)quinoxalin-6-ol?
The IUPAC name of 3-(1,1-difluoroethyl)quinoxalin-6-ol (CID 136602863) is 3-(1,1-difluoroethyl)quinoxalin-6-ol.
What is the SMILES notation for 3-(1,1-difluoroethyl)quinoxalin-6-ol?
The canonical SMILES for 3-(1,1-difluoroethyl)quinoxalin-6-ol is CC(F)(F)c1cnc2ccc(O)cc2n1.
What is the InChIKey of 3-(1,1-difluoroethyl)quinoxalin-6-ol?
The InChIKey is GHMHYZGFWIYXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O/c1-10(11,12)9-5-13-7-3-2-6(15)4-8(7)14-9/h2-5,15H,1H3.
What are the key properties of 3-(1,1-difluoroethyl)quinoxalin-6-ol?
3-(1,1-difluoroethyl)quinoxalin-6-ol has a molecular weight of 210.18 g/mol, XLogP of 2.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1-difluoroethyl)quinoxalin-6-ol is sourced from PubChem (CID 136602863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).