(2,3,8-trimethylquinoxalin-6-yl)methanol

C12H14N2O — CID 21098099

IUPAC(2,3,8-trimethylquinoxalin-6-yl)methanol
SMILESCc1nc2cc(CO)cc(C)c2nc1C
InChIInChI=1S/C12H14N2O/c1-7-4-10(6-15)5-11-12(7)14-9(3)8(2)13-11/h4-5,15H,6H2,1-3H3
InChIKeyHKTHMNDTVLMALJ-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.05
Rot. Bonds1

About (2,3,8-trimethylquinoxalin-6-yl)methanol

(2,3,8-trimethylquinoxalin-6-yl)methanol (PubChem CID 21098099) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is (2,3,8-trimethylquinoxalin-6-yl)methanol.

Molecular Properties

Compound Name(2,3,8-trimethylquinoxalin-6-yl)methanol
PubChem CID21098099
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name(2,3,8-trimethylquinoxalin-6-yl)methanol
SMILESCc1nc2cc(CO)cc(C)c2nc1C
InChIInChI=1S/C12H14N2O/c1-7-4-10(6-15)5-11-12(7)14-9(3)8(2)13-11/h4-5,15H,6H2,1-3H3
InChIKeyHKTHMNDTVLMALJ-UHFFFAOYSA-N
XLogP2.05
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2,3,8-trimethylquinoxalin-6-yl)methanol 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 (2,3,8-trimethylquinoxalin-6-yl)methanol?
The IUPAC name of (2,3,8-trimethylquinoxalin-6-yl)methanol (CID 21098099) is (2,3,8-trimethylquinoxalin-6-yl)methanol.
What is the SMILES notation for (2,3,8-trimethylquinoxalin-6-yl)methanol?
The canonical SMILES for (2,3,8-trimethylquinoxalin-6-yl)methanol is Cc1nc2cc(CO)cc(C)c2nc1C.
What is the InChIKey of (2,3,8-trimethylquinoxalin-6-yl)methanol?
The InChIKey is HKTHMNDTVLMALJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-7-4-10(6-15)5-11-12(7)14-9(3)8(2)13-11/h4-5,15H,6H2,1-3H3.
What are the key properties of (2,3,8-trimethylquinoxalin-6-yl)methanol?
(2,3,8-trimethylquinoxalin-6-yl)methanol has a molecular weight of 202.26 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,8-trimethylquinoxalin-6-yl)methanol is sourced from PubChem (CID 21098099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).