6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine

C10H13NS — CID 143185910

IUPAC6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine
SMILESCCC1N=c2sccc2=CC1C
InChIInChI=1S/C10H13NS/c1-3-9-7(2)6-8-4-5-12-10(8)11-9/h4-7,9H,3H2,1-2H3
InChIKeyJADHZBOBUQDUAI-UHFFFAOYSA-N
MW179.29 g/mol
LogP1.58
Rot. Bonds1

About 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine

6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine (PubChem CID 143185910) has the molecular formula C10H13NS and a molecular weight of 179.29 g/mol. Its IUPAC name is 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine.

Molecular Properties

Compound Name6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine
PubChem CID143185910
Molecular FormulaC10H13NS
Molecular Weight179.29 g/mol
Exact Mass179.08
IUPAC Name6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine
SMILESCCC1N=c2sccc2=CC1C
InChIInChI=1S/C10H13NS/c1-3-9-7(2)6-8-4-5-12-10(8)11-9/h4-7,9H,3H2,1-2H3
InChIKeyJADHZBOBUQDUAI-UHFFFAOYSA-N
XLogP1.58
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.29
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Propan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 57865914
2-(2-Methylpropyl)-3a,7a-dihydro-1,3-benzothiazole
CID 58592540
6-Propan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 59529715
4,5-Dimethyl-3a,7a-dihydro-1,3-benzothiazole
CID 89495238
2-Buta-1,3-dien-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 118616219
5-Propan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 122629330
(7aR)-4-methyl-3a,7a-dihydro-1,3-benzothiazole
CID 132094388
(3E)-N-ethyl-3-(3-methylpentan-2-ylidene)thiophen-2-imine
CID 153342670
6-Tert-butyl-5,6-dihydrothieno[2,3-b]pyridine
CID 155118555
4-Propan-2-yl-3a,7a-dihydro-1,3-benzothiazole
CID 156061300
6-Butan-2-yl-2-methyl-3a,7a-dihydro-1,3-benzothiazole
CID 163953630
5-(2,2-Dimethylpropyl)-3a,7a-dihydro-1,3-benzothiazole
CID 167062065

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine?
The IUPAC name of 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine (CID 143185910) is 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine.
What is the SMILES notation for 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine?
The canonical SMILES for 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine is CCC1N=c2sccc2=CC1C.
What is the InChIKey of 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine?
The InChIKey is JADHZBOBUQDUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NS/c1-3-9-7(2)6-8-4-5-12-10(8)11-9/h4-7,9H,3H2,1-2H3.
What are the key properties of 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine?
6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine has a molecular weight of 179.29 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-5,6-dihydrothieno[2,3-b]pyridine is sourced from PubChem (CID 143185910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).