3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine

C14H10INOS — CID 71664873

IUPAC3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine
SMILESCOc1ccc(-c2sc3cccnc3c2I)cc1
InChIInChI=1S/C14H10INOS/c1-17-10-6-4-9(5-7-10)14-12(15)13-11(18-14)3-2-8-16-13/h2-8H,1H3
InChIKeyFUXYJBNHKPVKIV-UHFFFAOYSA-N
MW367.21 g/mol
LogP4.58
Rot. Bonds2

About 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine

3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine (PubChem CID 71664873) has the molecular formula C14H10INOS and a molecular weight of 367.21 g/mol. Its IUPAC name is 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine.

Molecular Properties

Compound Name3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine
PubChem CID71664873
Molecular FormulaC14H10INOS
Molecular Weight367.21 g/mol
Exact Mass366.95
IUPAC Name3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine
SMILESCOc1ccc(-c2sc3cccnc3c2I)cc1
InChIInChI=1S/C14H10INOS/c1-17-10-6-4-9(5-7-10)14-12(15)13-11(18-14)3-2-8-16-13/h2-8H,1H3
InChIKeyFUXYJBNHKPVKIV-UHFFFAOYSA-N
XLogP4.58
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.21
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine?
The IUPAC name of 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine (CID 71664873) is 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine.
What is the SMILES notation for 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine?
The canonical SMILES for 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine is COc1ccc(-c2sc3cccnc3c2I)cc1.
What is the InChIKey of 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine?
The InChIKey is FUXYJBNHKPVKIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10INOS/c1-17-10-6-4-9(5-7-10)14-12(15)13-11(18-14)3-2-8-16-13/h2-8H,1H3.
What are the key properties of 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine?
3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine has a molecular weight of 367.21 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-2-(4-methoxyphenyl)thieno[3,2-b]pyridine is sourced from PubChem (CID 71664873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).