4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol

C8H11NOS — CID 71777789

IUPAC4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol
SMILESOCC1NCCc2sccc21
InChIInChI=1S/C8H11NOS/c10-5-7-6-2-4-11-8(6)1-3-9-7/h2,4,7,9-10H,1,3,5H2
InChIKeyVJQBIPPJWWDFOF-UHFFFAOYSA-N
MW169.25 g/mol
LogP0.93
Rot. Bonds1

About 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol

4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol (PubChem CID 71777789) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol.

Molecular Properties

Compound Name4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol
PubChem CID71777789
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol
SMILESOCC1NCCc2sccc21
InChIInChI=1S/C8H11NOS/c10-5-7-6-2-4-11-8(6)1-3-9-7/h2,4,7,9-10H,1,3,5H2
InChIKeyVJQBIPPJWWDFOF-UHFFFAOYSA-N
XLogP0.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol?
The IUPAC name of 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol (CID 71777789) is 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol.
What is the SMILES notation for 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol?
The canonical SMILES for 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol is OCC1NCCc2sccc21.
What is the InChIKey of 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol?
The InChIKey is VJQBIPPJWWDFOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c10-5-7-6-2-4-11-8(6)1-3-9-7/h2,4,7,9-10H,1,3,5H2.
What are the key properties of 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol?
4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol has a molecular weight of 169.25 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydrothieno[3,2-c]pyridin-4-ylmethanol is sourced from PubChem (CID 71777789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).