oxolan-3-yl(quinoxalin-2-yl)methanol

C13H14N2O2 — CID 107357628

IUPACoxolan-3-yl(quinoxalin-2-yl)methanol
SMILESOC(c1cnc2ccccc2n1)C1CCOC1
InChIInChI=1S/C13H14N2O2/c16-13(9-5-6-17-8-9)12-7-14-10-3-1-2-4-11(10)15-12/h1-4,7,9,13,16H,5-6,8H2
InChIKeyFTIATMDGFYKYIQ-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.70
Rot. Bonds2

About oxolan-3-yl(quinoxalin-2-yl)methanol

oxolan-3-yl(quinoxalin-2-yl)methanol (PubChem CID 107357628) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is oxolan-3-yl(quinoxalin-2-yl)methanol.

Molecular Properties

Compound Nameoxolan-3-yl(quinoxalin-2-yl)methanol
PubChem CID107357628
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Nameoxolan-3-yl(quinoxalin-2-yl)methanol
SMILESOC(c1cnc2ccccc2n1)C1CCOC1
InChIInChI=1S/C13H14N2O2/c16-13(9-5-6-17-8-9)12-7-14-10-3-1-2-4-11(10)15-12/h1-4,7,9,13,16H,5-6,8H2
InChIKeyFTIATMDGFYKYIQ-UHFFFAOYSA-N
XLogP1.70
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of oxolan-3-yl(quinoxalin-2-yl)methanol?
The IUPAC name of oxolan-3-yl(quinoxalin-2-yl)methanol (CID 107357628) is oxolan-3-yl(quinoxalin-2-yl)methanol.
What is the SMILES notation for oxolan-3-yl(quinoxalin-2-yl)methanol?
The canonical SMILES for oxolan-3-yl(quinoxalin-2-yl)methanol is OC(c1cnc2ccccc2n1)C1CCOC1.
What is the InChIKey of oxolan-3-yl(quinoxalin-2-yl)methanol?
The InChIKey is FTIATMDGFYKYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c16-13(9-5-6-17-8-9)12-7-14-10-3-1-2-4-11(10)15-12/h1-4,7,9,13,16H,5-6,8H2.
What are the key properties of oxolan-3-yl(quinoxalin-2-yl)methanol?
oxolan-3-yl(quinoxalin-2-yl)methanol has a molecular weight of 230.27 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-3-yl(quinoxalin-2-yl)methanol is sourced from PubChem (CID 107357628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).