2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol

C15H11Cl2NOS — CID 81143648

IUPAC2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1c(Cl)cccc1Cl)c1cnc2ccsc2c1
InChIInChI=1S/C15H11Cl2NOS/c16-11-2-1-3-12(17)10(11)7-14(19)9-6-15-13(18-8-9)4-5-20-15/h1-6,8,14,19H,7H2
InChIKeyDXYFKKGJQCSSAB-UHFFFAOYSA-N
MW324.23 g/mol
LogP4.88
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol

2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol (PubChem CID 81143648) has the molecular formula C15H11Cl2NOS and a molecular weight of 324.23 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
PubChem CID81143648
Molecular FormulaC15H11Cl2NOS
Molecular Weight324.23 g/mol
Exact Mass322.99
IUPAC Name2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1c(Cl)cccc1Cl)c1cnc2ccsc2c1
InChIInChI=1S/C15H11Cl2NOS/c16-11-2-1-3-12(17)10(11)7-14(19)9-6-15-13(18-8-9)4-5-20-15/h1-6,8,14,19H,7H2
InChIKeyDXYFKKGJQCSSAB-UHFFFAOYSA-N
XLogP4.88
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.23
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81143765
1-thieno[3,2-b]pyridin-6-yl-2-thiophen-3-ylethanol
CID 81144126
2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81144222
1-thieno[3,2-b]pyridin-6-ylbut-3-en-1-ol
CID 81144232
2,6-dichloro-N-(1-thieno[3,2-b]pyridin-6-ylethyl)aniline
CID 65467399
2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanone
CID 81146391
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
2-(5-bromo-2-fluorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81144033
2-(2-chloro-6-fluorophenyl)-1-quinolin-3-ylethanol
CID 63022138
[3-(2-methylpropyl)phenyl]-thieno[3,2-b]pyridin-6-ylmethanol
CID 116543760
2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol
CID 62489843
2,2-dimethyl-1-thieno[3,2-b]pyridin-6-ylpropan-1-ol
CID 81143466

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The IUPAC name of 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol (CID 81143648) is 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The canonical SMILES for 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol is OC(Cc1c(Cl)cccc1Cl)c1cnc2ccsc2c1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The InChIKey is DXYFKKGJQCSSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NOS/c16-11-2-1-3-12(17)10(11)7-14(19)9-6-15-13(18-8-9)4-5-20-15/h1-6,8,14,19H,7H2.
What are the key properties of 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol has a molecular weight of 324.23 g/mol, XLogP of 4.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol is sourced from PubChem (CID 81143648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).