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

C8H9NS — CID 91042216

IUPAC6-methyl-3a,6-dihydrothieno[3,2-b]pyridine
SMILESCC1C=NC2C=CSC2=C1
InChIInChI=1S/C8H9NS/c1-6-4-8-7(9-5-6)2-3-10-8/h2-7H,1H3
InChIKeyGMUXGYFACRMKIB-UHFFFAOYSA-N
MW151.23 g/mol
LogP2.22
Rot. Bonds

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

6-methyl-3a,6-dihydrothieno[3,2-b]pyridine (PubChem CID 91042216) has the molecular formula C8H9NS and a molecular weight of 151.23 g/mol. Its IUPAC name is 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine.

Molecular Properties

Compound Name6-methyl-3a,6-dihydrothieno[3,2-b]pyridine
PubChem CID91042216
Molecular FormulaC8H9NS
Molecular Weight151.23 g/mol
Exact Mass151.05
IUPAC Name6-methyl-3a,6-dihydrothieno[3,2-b]pyridine
SMILESCC1C=NC2C=CSC2=C1
InChIInChI=1S/C8H9NS/c1-6-4-8-7(9-5-6)2-3-10-8/h2-7H,1H3
InChIKeyGMUXGYFACRMKIB-UHFFFAOYSA-N
XLogP2.22
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methyl-3-methylsulfanyl-2,5-dihydropyridine
CID 57325034
6-Methyl-3a,7a-dihydrothieno[3,2-b]pyridine
CID 57585669
2-Propan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 57865914
2-(2-Methylpropyl)-3a,7a-dihydro-1,3-benzothiazole
CID 58592540
3a,6-Dihydrothieno[3,2-b]pyridine
CID 91369453
4-Methyl-3a,4-dihydrothieno[3,2-c]pyridine
CID 126498618
6-Propan-2-yl-3a,7a-dihydro-[1,3]thiazolo[5,4-c]pyridine
CID 170375121
2-Butan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 173797298

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine?
The IUPAC name of 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine (CID 91042216) is 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine.
What is the SMILES notation for 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine?
The canonical SMILES for 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine is CC1C=NC2C=CSC2=C1.
What is the InChIKey of 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine?
The InChIKey is GMUXGYFACRMKIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NS/c1-6-4-8-7(9-5-6)2-3-10-8/h2-7H,1H3.
What are the key properties of 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine?
6-methyl-3a,6-dihydrothieno[3,2-b]pyridine has a molecular weight of 151.23 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3a,6-dihydrothieno[3,2-b]pyridine is sourced from PubChem (CID 91042216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).