2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol

C17H16N2O — CID 89487150

IUPAC2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol
SMILESCc1cccc2nc(CCO)c(-c3ccccc3)nc12
InChIInChI=1S/C17H16N2O/c1-12-6-5-9-14-16(12)19-17(15(18-14)10-11-20)13-7-3-2-4-8-13/h2-9,20H,10-11H2,1H3
InChIKeyPQKDIWYSNWZBTA-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.14
Rot. Bonds3

About 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol

2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol (PubChem CID 89487150) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol
PubChem CID89487150
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol
SMILESCc1cccc2nc(CCO)c(-c3ccccc3)nc12
InChIInChI=1S/C17H16N2O/c1-12-6-5-9-14-16(12)19-17(15(18-14)10-11-20)13-7-3-2-4-8-13/h2-9,20H,10-11H2,1H3
InChIKeyPQKDIWYSNWZBTA-UHFFFAOYSA-N
XLogP3.14
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol?
The IUPAC name of 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol (CID 89487150) is 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol.
What is the SMILES notation for 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol?
The canonical SMILES for 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol is Cc1cccc2nc(CCO)c(-c3ccccc3)nc12.
What is the InChIKey of 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol?
The InChIKey is PQKDIWYSNWZBTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-6-5-9-14-16(12)19-17(15(18-14)10-11-20)13-7-3-2-4-8-13/h2-9,20H,10-11H2,1H3.
What are the key properties of 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol?
2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol has a molecular weight of 264.33 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-3-phenylquinoxalin-2-yl)ethanol is sourced from PubChem (CID 89487150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).