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

C15H13NOS — CID 105079392

IUPAC1-quinolin-3-yl-2-thiophen-3-ylethanol
SMILESOC(Cc1ccsc1)c1cnc2ccccc2c1
InChIInChI=1S/C15H13NOS/c17-15(7-11-5-6-18-10-11)13-8-12-3-1-2-4-14(12)16-9-13/h1-6,8-10,15,17H,7H2
InChIKeyYNYWFUVWTHAHCK-UHFFFAOYSA-N
MW255.34 g/mol
LogP3.57
Rot. Bonds3

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

1-quinolin-3-yl-2-thiophen-3-ylethanol (PubChem CID 105079392) has the molecular formula C15H13NOS and a molecular weight of 255.34 g/mol. Its IUPAC name is 1-quinolin-3-yl-2-thiophen-3-ylethanol.

Molecular Properties

Compound Name1-quinolin-3-yl-2-thiophen-3-ylethanol
PubChem CID105079392
Molecular FormulaC15H13NOS
Molecular Weight255.34 g/mol
Exact Mass255.07
IUPAC Name1-quinolin-3-yl-2-thiophen-3-ylethanol
SMILESOC(Cc1ccsc1)c1cnc2ccccc2c1
InChIInChI=1S/C15H13NOS/c17-15(7-11-5-6-18-10-11)13-8-12-3-1-2-4-14(12)16-9-13/h1-6,8-10,15,17H,7H2
InChIKeyYNYWFUVWTHAHCK-UHFFFAOYSA-N
XLogP3.57
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-thieno[3,2-b]pyridin-6-yl-2-thiophen-3-ylethanol
CID 81144126
1-quinolin-3-ylbutan-1-ol
CID 60924193
1-quinolin-3-ylbut-3-en-1-ol
CID 77273716
1-quinolin-3-yl-4-thiophen-2-ylbutan-1-ol
CID 105079373
fluoro(quinolin-3-yl)methanol
CID 163892772
1-isoquinolin-4-yl-2-thiophen-3-ylethanol
CID 104504569
2-(2-chloro-6-fluorophenyl)-1-quinolin-3-ylethanol
CID 63022138
1-quinoxalin-2-yl-2-thiophen-3-ylethanamine
CID 107357052
(1-quinoxalin-2-yl-2-thiophen-3-ylethyl)hydrazine
CID 107357846
N-quinolin-3-yl-3-thiophen-3-ylpropanamide
CID 29330989
2-cyclohexylsulfanyl-1-quinolin-3-ylethanol
CID 65140040
1-(5-methoxy-3-pyridinyl)-2-thiophen-3-ylethanol
CID 105121291

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-3-yl-2-thiophen-3-ylethanol?
The IUPAC name of 1-quinolin-3-yl-2-thiophen-3-ylethanol (CID 105079392) is 1-quinolin-3-yl-2-thiophen-3-ylethanol.
What is the SMILES notation for 1-quinolin-3-yl-2-thiophen-3-ylethanol?
The canonical SMILES for 1-quinolin-3-yl-2-thiophen-3-ylethanol is OC(Cc1ccsc1)c1cnc2ccccc2c1.
What is the InChIKey of 1-quinolin-3-yl-2-thiophen-3-ylethanol?
The InChIKey is YNYWFUVWTHAHCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NOS/c17-15(7-11-5-6-18-10-11)13-8-12-3-1-2-4-14(12)16-9-13/h1-6,8-10,15,17H,7H2.
What are the key properties of 1-quinolin-3-yl-2-thiophen-3-ylethanol?
1-quinolin-3-yl-2-thiophen-3-ylethanol has a molecular weight of 255.34 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-3-yl-2-thiophen-3-ylethanol is sourced from PubChem (CID 105079392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).