2-(2-methylthiophen-3-yl)-6-phenoxypyridine

C16H13NOS — CID 70595338

IUPAC2-(2-methylthiophen-3-yl)-6-phenoxypyridine
SMILESCc1sccc1-c1cccc(Oc2ccccc2)n1
InChIInChI=1S/C16H13NOS/c1-12-14(10-11-19-12)15-8-5-9-16(17-15)18-13-6-3-2-4-7-13/h2-11H,1H3
InChIKeyHKMWZEXZYIDVFO-UHFFFAOYSA-N
MW267.35 g/mol
LogP4.91
Rot. Bonds3

About 2-(2-methylthiophen-3-yl)-6-phenoxypyridine

2-(2-methylthiophen-3-yl)-6-phenoxypyridine (PubChem CID 70595338) has the molecular formula C16H13NOS and a molecular weight of 267.35 g/mol. Its IUPAC name is 2-(2-methylthiophen-3-yl)-6-phenoxypyridine.

Molecular Properties

Compound Name2-(2-methylthiophen-3-yl)-6-phenoxypyridine
PubChem CID70595338
Molecular FormulaC16H13NOS
Molecular Weight267.35 g/mol
Exact Mass267.07
IUPAC Name2-(2-methylthiophen-3-yl)-6-phenoxypyridine
SMILESCc1sccc1-c1cccc(Oc2ccccc2)n1
InChIInChI=1S/C16H13NOS/c1-12-14(10-11-19-12)15-8-5-9-16(17-15)18-13-6-3-2-4-7-13/h2-11H,1H3
InChIKeyHKMWZEXZYIDVFO-UHFFFAOYSA-N
XLogP4.91
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-methylthiophen-3-yl)-6-phenoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylthiophen-3-yl)-6-phenoxypyridine?
The IUPAC name of 2-(2-methylthiophen-3-yl)-6-phenoxypyridine (CID 70595338) is 2-(2-methylthiophen-3-yl)-6-phenoxypyridine.
What is the SMILES notation for 2-(2-methylthiophen-3-yl)-6-phenoxypyridine?
The canonical SMILES for 2-(2-methylthiophen-3-yl)-6-phenoxypyridine is Cc1sccc1-c1cccc(Oc2ccccc2)n1.
What is the InChIKey of 2-(2-methylthiophen-3-yl)-6-phenoxypyridine?
The InChIKey is HKMWZEXZYIDVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NOS/c1-12-14(10-11-19-12)15-8-5-9-16(17-15)18-13-6-3-2-4-7-13/h2-11H,1H3.
What are the key properties of 2-(2-methylthiophen-3-yl)-6-phenoxypyridine?
2-(2-methylthiophen-3-yl)-6-phenoxypyridine has a molecular weight of 267.35 g/mol, XLogP of 4.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylthiophen-3-yl)-6-phenoxypyridine is sourced from PubChem (CID 70595338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).