2-quinolin-3-ylethanol

C11H11NO — CID 53403774

IUPAC2-quinolin-3-ylethanol
SMILESOCCc1cnc2ccccc2c1
InChIInChI=1S/C11H11NO/c13-6-5-9-7-10-3-1-2-4-11(10)12-8-9/h1-4,7-8,13H,5-6H2
InChIKeyKMYODCXGVMLGJT-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.77
Rot. Bonds2

About 2-quinolin-3-ylethanol

2-quinolin-3-ylethanol (PubChem CID 53403774) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is 2-quinolin-3-ylethanol.

Molecular Properties

Compound Name2-quinolin-3-ylethanol
PubChem CID53403774
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name2-quinolin-3-ylethanol
SMILESOCCc1cnc2ccccc2c1
InChIInChI=1S/C11H11NO/c13-6-5-9-7-10-3-1-2-4-11(10)12-8-9/h1-4,7-8,13H,5-6H2
InChIKeyKMYODCXGVMLGJT-UHFFFAOYSA-N
XLogP1.77
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-quinolin-3-ylethanamine;hydrochloride
CID 68724239
3-(3,3-dimethylbutyl)quinoline
CID 58808300
3-(2-phenoxyethyl)quinoline
CID 54129983
O-(3-quinolin-3-ylpropyl)hydroxylamine
CID 54489779
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553
quinoline-3-carbaldehyde;quinolin-3-ylmethanol
CID 87606996
2-[propan-2-yl(quinolin-3-ylmethyl)amino]ethanol
CID 113345069
3-(2-methylpropyl)quinoline
CID 12072851
3-(2,2,2-trifluoroethyl)quinoline
CID 102230069
3-(3-ethoxypropyl)quinoline
CID 91801315
3-(3-chloro-4-methylpentyl)quinoline
CID 64508881
2-methyl-N-(3-quinolin-3-ylpropyl)propan-2-amine
CID 64506111

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-3-ylethanol?
The IUPAC name of 2-quinolin-3-ylethanol (CID 53403774) is 2-quinolin-3-ylethanol.
What is the SMILES notation for 2-quinolin-3-ylethanol?
The canonical SMILES for 2-quinolin-3-ylethanol is OCCc1cnc2ccccc2c1.
What is the InChIKey of 2-quinolin-3-ylethanol?
The InChIKey is KMYODCXGVMLGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c13-6-5-9-7-10-3-1-2-4-11(10)12-8-9/h1-4,7-8,13H,5-6H2.
What are the key properties of 2-quinolin-3-ylethanol?
2-quinolin-3-ylethanol has a molecular weight of 173.22 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-3-ylethanol is sourced from PubChem (CID 53403774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).