4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine

C15H13NS — CID 167260692

IUPAC4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine
SMILESCc1cc(C)cc(-c2nccc3sccc23)c1
InChIInChI=1S/C15H13NS/c1-10-7-11(2)9-12(8-10)15-13-4-6-17-14(13)3-5-16-15/h3-9H,1-2H3
InChIKeyHCEBXYJOGYWWGH-UHFFFAOYSA-N
MW239.34 g/mol
LogP4.58
Rot. Bonds1

About 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine

4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine (PubChem CID 167260692) has the molecular formula C15H13NS and a molecular weight of 239.34 g/mol. Its IUPAC name is 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine
PubChem CID167260692
Molecular FormulaC15H13NS
Molecular Weight239.34 g/mol
Exact Mass239.08
IUPAC Name4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine
SMILESCc1cc(C)cc(-c2nccc3sccc23)c1
InChIInChI=1S/C15H13NS/c1-10-7-11(2)9-12(8-10)15-13-4-6-17-14(13)3-5-16-15/h3-9H,1-2H3
InChIKeyHCEBXYJOGYWWGH-UHFFFAOYSA-N
XLogP4.58
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine?
The IUPAC name of 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine (CID 167260692) is 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine.
What is the SMILES notation for 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine?
The canonical SMILES for 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine is Cc1cc(C)cc(-c2nccc3sccc23)c1.
What is the InChIKey of 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine?
The InChIKey is HCEBXYJOGYWWGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NS/c1-10-7-11(2)9-12(8-10)15-13-4-6-17-14(13)3-5-16-15/h3-9H,1-2H3.
What are the key properties of 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine?
4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine has a molecular weight of 239.34 g/mol, XLogP of 4.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylphenyl)thieno[3,2-c]pyridine is sourced from PubChem (CID 167260692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).