2-(1,2-dihydroquinolin-2-yl)ethanol

C11H13NO — CID 68887406

IUPAC2-(1,2-dihydroquinolin-2-yl)ethanol
SMILESOCCC1C=Cc2ccccc2N1
InChIInChI=1S/C11H13NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12-10/h1-6,10,12-13H,7-8H2
InChIKeyZTHIQDOOVDHOJS-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.88
Rot. Bonds2

About 2-(1,2-dihydroquinolin-2-yl)ethanol

2-(1,2-dihydroquinolin-2-yl)ethanol (PubChem CID 68887406) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 2-(1,2-dihydroquinolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1,2-dihydroquinolin-2-yl)ethanol
PubChem CID68887406
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name2-(1,2-dihydroquinolin-2-yl)ethanol
SMILESOCCC1C=Cc2ccccc2N1
InChIInChI=1S/C11H13NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12-10/h1-6,10,12-13H,7-8H2
InChIKeyZTHIQDOOVDHOJS-UHFFFAOYSA-N
XLogP1.88
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dihydroquinolin-2-yl)ethanol?
The IUPAC name of 2-(1,2-dihydroquinolin-2-yl)ethanol (CID 68887406) is 2-(1,2-dihydroquinolin-2-yl)ethanol.
What is the SMILES notation for 2-(1,2-dihydroquinolin-2-yl)ethanol?
The canonical SMILES for 2-(1,2-dihydroquinolin-2-yl)ethanol is OCCC1C=Cc2ccccc2N1.
What is the InChIKey of 2-(1,2-dihydroquinolin-2-yl)ethanol?
The InChIKey is ZTHIQDOOVDHOJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12-10/h1-6,10,12-13H,7-8H2.
What are the key properties of 2-(1,2-dihydroquinolin-2-yl)ethanol?
2-(1,2-dihydroquinolin-2-yl)ethanol has a molecular weight of 175.23 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dihydroquinolin-2-yl)ethanol is sourced from PubChem (CID 68887406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).