1-quinolin-3-yl-1-thiophen-2-ylethanol

C15H13NOS — CID 55163309

IUPAC1-quinolin-3-yl-1-thiophen-2-ylethanol
SMILESCC(O)(c1cnc2ccccc2c1)c1cccs1
InChIInChI=1S/C15H13NOS/c1-15(17,14-7-4-8-18-14)12-9-11-5-2-3-6-13(11)16-10-12/h2-10,17H,1H3
InChIKeyLNODLYJCURBKIJ-UHFFFAOYSA-N
MW255.34 g/mol
LogP3.55
Rot. Bonds2

About 1-quinolin-3-yl-1-thiophen-2-ylethanol

1-quinolin-3-yl-1-thiophen-2-ylethanol (PubChem CID 55163309) has the molecular formula C15H13NOS and a molecular weight of 255.34 g/mol. Its IUPAC name is 1-quinolin-3-yl-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-quinolin-3-yl-1-thiophen-2-ylethanol
PubChem CID55163309
Molecular FormulaC15H13NOS
Molecular Weight255.34 g/mol
Exact Mass255.07
IUPAC Name1-quinolin-3-yl-1-thiophen-2-ylethanol
SMILESCC(O)(c1cnc2ccccc2c1)c1cccs1
InChIInChI=1S/C15H13NOS/c1-15(17,14-7-4-8-18-14)12-9-11-5-2-3-6-13(11)16-10-12/h2-10,17H,1H3
InChIKeyLNODLYJCURBKIJ-UHFFFAOYSA-N
XLogP3.55
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-phenyl-1-thiophen-2-ylethanol
CID 674763
1-(2-methoxyphenyl)-1-quinolin-3-ylethanol
CID 60924956
1-(3-methoxyphenyl)-1-quinolin-3-ylethanol
CID 60924847
1-(3,4-dichlorophenyl)-1-thiophen-2-ylethanol
CID 63220767
1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol
CID 65099550
(E)-2-methyl-4-quinolin-3-ylbut-3-en-2-ol
CID 134838021
1-cyclopropyl-1-quinolin-3-ylpropan-1-ol
CID 64918922
1-(1-ethylpyrazol-4-yl)-1-thiophen-2-ylethanol
CID 63220679
1-(7-tert-butylnaphthalen-2-yl)-2-quinolin-3-ylpropan-2-ol
CID 91563898
1-(4-fluorophenyl)-2-quinolin-3-ylpropan-2-amine
CID 114833902
4-methyl-4-quinolin-3-ylpentan-2-amine
CID 64718063
2-hydroxy-2-methyl-1-quinolin-3-ylpropan-1-one
CID 103446227

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-3-yl-1-thiophen-2-ylethanol?
The IUPAC name of 1-quinolin-3-yl-1-thiophen-2-ylethanol (CID 55163309) is 1-quinolin-3-yl-1-thiophen-2-ylethanol.
What is the SMILES notation for 1-quinolin-3-yl-1-thiophen-2-ylethanol?
The canonical SMILES for 1-quinolin-3-yl-1-thiophen-2-ylethanol is CC(O)(c1cnc2ccccc2c1)c1cccs1.
What is the InChIKey of 1-quinolin-3-yl-1-thiophen-2-ylethanol?
The InChIKey is LNODLYJCURBKIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NOS/c1-15(17,14-7-4-8-18-14)12-9-11-5-2-3-6-13(11)16-10-12/h2-10,17H,1H3.
What are the key properties of 1-quinolin-3-yl-1-thiophen-2-ylethanol?
1-quinolin-3-yl-1-thiophen-2-ylethanol has a molecular weight of 255.34 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-3-yl-1-thiophen-2-ylethanol is sourced from PubChem (CID 55163309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).