6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine

C9H11NOS — CID 89069766

IUPAC6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine
SMILESCOc1cnc2c(c1)SC(C)C2
InChIInChI=1S/C9H11NOS/c1-6-3-8-9(12-6)4-7(11-2)5-10-8/h4-6H,3H2,1-2H3
InChIKeyFOBGQOQCCFJMDQ-UHFFFAOYSA-N
MW181.26 g/mol
LogP2.13
Rot. Bonds1

About 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine

6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine (PubChem CID 89069766) has the molecular formula C9H11NOS and a molecular weight of 181.26 g/mol. Its IUPAC name is 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine.

Molecular Properties

Compound Name6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine
PubChem CID89069766
Molecular FormulaC9H11NOS
Molecular Weight181.26 g/mol
Exact Mass181.06
IUPAC Name6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine
SMILESCOc1cnc2c(c1)SC(C)C2
InChIInChI=1S/C9H11NOS/c1-6-3-8-9(12-6)4-7(11-2)5-10-8/h4-6H,3H2,1-2H3
InChIKeyFOBGQOQCCFJMDQ-UHFFFAOYSA-N
XLogP2.13
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine?
The IUPAC name of 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine (CID 89069766) is 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine.
What is the SMILES notation for 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine?
The canonical SMILES for 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine is COc1cnc2c(c1)SC(C)C2.
What is the InChIKey of 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine?
The InChIKey is FOBGQOQCCFJMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NOS/c1-6-3-8-9(12-6)4-7(11-2)5-10-8/h4-6H,3H2,1-2H3.
What are the key properties of 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine?
6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine has a molecular weight of 181.26 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-2,3-dihydrothieno[3,2-b]pyridine is sourced from PubChem (CID 89069766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).