ethane;3-methylthieno[3,4-c]pyridine

C10H13NS — CID 144655505

IUPACethane;3-methylthieno[3,4-c]pyridine
SMILESCC.Cc1scc2ccncc12
InChIInChI=1S/C8H7NS.C2H6/c1-6-8-4-9-3-2-7(8)5-10-6;1-2/h2-5H,1H3;1-2H3
InChIKeyNZNQGLHETOLUBF-UHFFFAOYSA-N
MW179.29 g/mol
LogP3.63
Rot. Bonds

About ethane;3-methylthieno[3,4-c]pyridine

ethane;3-methylthieno[3,4-c]pyridine (PubChem CID 144655505) has the molecular formula C10H13NS and a molecular weight of 179.29 g/mol. Its IUPAC name is ethane;3-methylthieno[3,4-c]pyridine.

Molecular Properties

Compound Nameethane;3-methylthieno[3,4-c]pyridine
PubChem CID144655505
Molecular FormulaC10H13NS
Molecular Weight179.29 g/mol
Exact Mass179.08
IUPAC Nameethane;3-methylthieno[3,4-c]pyridine
SMILESCC.Cc1scc2ccncc12
InChIInChI=1S/C8H7NS.C2H6/c1-6-8-4-9-3-2-7(8)5-10-6;1-2/h2-5H,1H3;1-2H3
InChIKeyNZNQGLHETOLUBF-UHFFFAOYSA-N
XLogP3.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.29
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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thieno[2,3-h]isoquinoline
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ethane;6-methylisoquinoline
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ethane;isoquinoline;hydroiodide
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CID 122389532
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,7-naphthyridin-1-amine
CID 166260063
1-isoquinolin-8-yl-2-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 103143412
2-(2,4-dimethylthiophen-3-yl)-3H-imidazo[4,5-c]pyridine
CID 67896478
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CID 156838859
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CID 125425947

Frequently Asked Questions

What is the IUPAC name of ethane;3-methylthieno[3,4-c]pyridine?
The IUPAC name of ethane;3-methylthieno[3,4-c]pyridine (CID 144655505) is ethane;3-methylthieno[3,4-c]pyridine.
What is the SMILES notation for ethane;3-methylthieno[3,4-c]pyridine?
The canonical SMILES for ethane;3-methylthieno[3,4-c]pyridine is CC.Cc1scc2ccncc12.
What is the InChIKey of ethane;3-methylthieno[3,4-c]pyridine?
The InChIKey is NZNQGLHETOLUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NS.C2H6/c1-6-8-4-9-3-2-7(8)5-10-6;1-2/h2-5H,1H3;1-2H3.
What are the key properties of ethane;3-methylthieno[3,4-c]pyridine?
ethane;3-methylthieno[3,4-c]pyridine has a molecular weight of 179.29 g/mol, XLogP of 3.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methylthieno[3,4-c]pyridine is sourced from PubChem (CID 144655505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).