2-(1-benzothiophen-2-yl)pyridine;methanol

C14H13NOS — CID 143810360

IUPAC2-(1-benzothiophen-2-yl)pyridine;methanol
SMILESCO.c1ccc(-c2cc3ccccc3s2)nc1
InChIInChI=1S/C13H9NS.CH4O/c1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;1-2/h1-9H;2H,1H3
InChIKeyZLDNOWIXRQSXQK-UHFFFAOYSA-N
MW243.33 g/mol
LogP3.57
Rot. Bonds1

About 2-(1-benzothiophen-2-yl)pyridine;methanol

2-(1-benzothiophen-2-yl)pyridine;methanol (PubChem CID 143810360) has the molecular formula C14H13NOS and a molecular weight of 243.33 g/mol. Its IUPAC name is 2-(1-benzothiophen-2-yl)pyridine;methanol.

Molecular Properties

Compound Name2-(1-benzothiophen-2-yl)pyridine;methanol
PubChem CID143810360
Molecular FormulaC14H13NOS
Molecular Weight243.33 g/mol
Exact Mass243.07
IUPAC Name2-(1-benzothiophen-2-yl)pyridine;methanol
SMILESCO.c1ccc(-c2cc3ccccc3s2)nc1
InChIInChI=1S/C13H9NS.CH4O/c1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;1-2/h1-9H;2H,1H3
InChIKeyZLDNOWIXRQSXQK-UHFFFAOYSA-N
XLogP3.57
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzothiophen-2-yl)pyridine;methanol?
The IUPAC name of 2-(1-benzothiophen-2-yl)pyridine;methanol (CID 143810360) is 2-(1-benzothiophen-2-yl)pyridine;methanol.
What is the SMILES notation for 2-(1-benzothiophen-2-yl)pyridine;methanol?
The canonical SMILES for 2-(1-benzothiophen-2-yl)pyridine;methanol is CO.c1ccc(-c2cc3ccccc3s2)nc1.
What is the InChIKey of 2-(1-benzothiophen-2-yl)pyridine;methanol?
The InChIKey is ZLDNOWIXRQSXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NS.CH4O/c1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;1-2/h1-9H;2H,1H3.
What are the key properties of 2-(1-benzothiophen-2-yl)pyridine;methanol?
2-(1-benzothiophen-2-yl)pyridine;methanol has a molecular weight of 243.33 g/mol, XLogP of 3.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzothiophen-2-yl)pyridine;methanol is sourced from PubChem (CID 143810360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).