3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine

C9H9NS — CID 89058111

IUPAC3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine
SMILESC=C1NC=Cc2scc(C)c21
InChIInChI=1S/C9H9NS/c1-6-5-11-8-3-4-10-7(2)9(6)8/h3-5,10H,2H2,1H3
InChIKeyQOOVPEYHLOYZSE-UHFFFAOYSA-N
MW163.24 g/mol
LogP2.60
Rot. Bonds

About 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine

3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine (PubChem CID 89058111) has the molecular formula C9H9NS and a molecular weight of 163.24 g/mol. Its IUPAC name is 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine.

Molecular Properties

Compound Name3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine
PubChem CID89058111
Molecular FormulaC9H9NS
Molecular Weight163.24 g/mol
Exact Mass163.05
IUPAC Name3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine
SMILESC=C1NC=Cc2scc(C)c21
InChIInChI=1S/C9H9NS/c1-6-5-11-8-3-4-10-7(2)9(6)8/h3-5,10H,2H2,1H3
InChIKeyQOOVPEYHLOYZSE-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine?
The IUPAC name of 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine (CID 89058111) is 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine.
What is the SMILES notation for 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine?
The canonical SMILES for 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine is C=C1NC=Cc2scc(C)c21.
What is the InChIKey of 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine?
The InChIKey is QOOVPEYHLOYZSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NS/c1-6-5-11-8-3-4-10-7(2)9(6)8/h3-5,10H,2H2,1H3.
What are the key properties of 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine?
3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine has a molecular weight of 163.24 g/mol, XLogP of 2.60, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-methylidene-5H-thieno[3,2-c]pyridine is sourced from PubChem (CID 89058111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).