2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol

C14H11ClN2OS — CID 81143765

IUPAC2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1ccncc1Cl)c1cnc2ccsc2c1
InChIInChI=1S/C14H11ClN2OS/c15-11-8-16-3-1-9(11)5-13(18)10-6-14-12(17-7-10)2-4-19-14/h1-4,6-8,13,18H,5H2
InChIKeyJEIPGVNBCDSCKT-UHFFFAOYSA-N
MW290.77 g/mol
LogP3.62
Rot. Bonds3

About 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol

2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol (PubChem CID 81143765) has the molecular formula C14H11ClN2OS and a molecular weight of 290.77 g/mol. Its IUPAC name is 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol.

Molecular Properties

Compound Name2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol
PubChem CID81143765
Molecular FormulaC14H11ClN2OS
Molecular Weight290.77 g/mol
Exact Mass290.03
IUPAC Name2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1ccncc1Cl)c1cnc2ccsc2c1
InChIInChI=1S/C14H11ClN2OS/c15-11-8-16-3-1-9(11)5-13(18)10-6-14-12(17-7-10)2-4-19-14/h1-4,6-8,13,18H,5H2
InChIKeyJEIPGVNBCDSCKT-UHFFFAOYSA-N
XLogP3.62
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81143648
2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81144222
1-thieno[3,2-b]pyridin-6-yl-2-thiophen-3-ylethanol
CID 81144126
2-(5-bromo-2-fluorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81144033
2-(3-chloro-4-pyridinyl)-1-(4-chlorothiophen-2-yl)ethanol
CID 79427524
1-thieno[3,2-b]pyridin-6-ylbut-3-en-1-ol
CID 81144232
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
[2-(2-chloro-4-methylphenyl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 106871462
1-(4-bromo-3-methylphenyl)-2-(3-chloro-4-pyridinyl)ethanol
CID 81446998
2-(2-chloro-5-fluorophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 102619203
4-(2-bromo-2-thieno[3,2-b]thiophen-5-ylethyl)-3-chloropyridine
CID 112656055
2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]thiophen-5-ylethanamine
CID 112655417

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The IUPAC name of 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol (CID 81143765) is 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol.
What is the SMILES notation for 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The canonical SMILES for 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol is OC(Cc1ccncc1Cl)c1cnc2ccsc2c1.
What is the InChIKey of 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The InChIKey is JEIPGVNBCDSCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2OS/c15-11-8-16-3-1-9(11)5-13(18)10-6-14-12(17-7-10)2-4-19-14/h1-4,6-8,13,18H,5H2.
What are the key properties of 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol has a molecular weight of 290.77 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol is sourced from PubChem (CID 81143765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).