4,7-dimethylthieno[3,2-c]pyridine;ethane

C11H15NS — CID 169134734

IUPAC4,7-dimethylthieno[3,2-c]pyridine;ethane
SMILESCC.Cc1ncc(C)c2sccc12
InChIInChI=1S/C9H9NS.C2H6/c1-6-5-10-7(2)8-3-4-11-9(6)8;1-2/h3-5H,1-2H3;1-2H3
InChIKeyYVRGMFAJYJXURS-UHFFFAOYSA-N
MW193.31 g/mol
LogP3.94
Rot. Bonds

About 4,7-dimethylthieno[3,2-c]pyridine;ethane

4,7-dimethylthieno[3,2-c]pyridine;ethane (PubChem CID 169134734) has the molecular formula C11H15NS and a molecular weight of 193.31 g/mol. Its IUPAC name is 4,7-dimethylthieno[3,2-c]pyridine;ethane.

Molecular Properties

Compound Name4,7-dimethylthieno[3,2-c]pyridine;ethane
PubChem CID169134734
Molecular FormulaC11H15NS
Molecular Weight193.31 g/mol
Exact Mass193.09
IUPAC Name4,7-dimethylthieno[3,2-c]pyridine;ethane
SMILESCC.Cc1ncc(C)c2sccc12
InChIInChI=1S/C9H9NS.C2H6/c1-6-5-10-7(2)8-3-4-11-9(6)8;1-2/h3-5H,1-2H3;1-2H3
InChIKeyYVRGMFAJYJXURS-UHFFFAOYSA-N
XLogP3.94
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethylthieno[3,2-c]pyridine;ethane?
The IUPAC name of 4,7-dimethylthieno[3,2-c]pyridine;ethane (CID 169134734) is 4,7-dimethylthieno[3,2-c]pyridine;ethane.
What is the SMILES notation for 4,7-dimethylthieno[3,2-c]pyridine;ethane?
The canonical SMILES for 4,7-dimethylthieno[3,2-c]pyridine;ethane is CC.Cc1ncc(C)c2sccc12.
What is the InChIKey of 4,7-dimethylthieno[3,2-c]pyridine;ethane?
The InChIKey is YVRGMFAJYJXURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NS.C2H6/c1-6-5-10-7(2)8-3-4-11-9(6)8;1-2/h3-5H,1-2H3;1-2H3.
What are the key properties of 4,7-dimethylthieno[3,2-c]pyridine;ethane?
4,7-dimethylthieno[3,2-c]pyridine;ethane has a molecular weight of 193.31 g/mol, XLogP of 3.94, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethylthieno[3,2-c]pyridine;ethane is sourced from PubChem (CID 169134734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).