3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine

C8H11NS — CID 18377318

IUPAC3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
SMILESCc1csc2c1CNCC2
InChIInChI=1S/C8H11NS/c1-6-5-10-8-2-3-9-4-7(6)8/h5,9H,2-4H2,1H3
InChIKeyZUZMVTSAPQEJGT-UHFFFAOYSA-N
MW153.25 g/mol
LogP1.70
Rot. Bonds

About 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine

3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine (PubChem CID 18377318) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
PubChem CID18377318
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
SMILESCc1csc2c1CNCC2
InChIInChI=1S/C8H11NS/c1-6-5-10-8-2-3-9-4-7(6)8/h5,9H,2-4H2,1H3
InChIKeyZUZMVTSAPQEJGT-UHFFFAOYSA-N
XLogP1.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The IUPAC name of 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine (CID 18377318) is 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine.
What is the SMILES notation for 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The canonical SMILES for 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine is Cc1csc2c1CNCC2.
What is the InChIKey of 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The InChIKey is ZUZMVTSAPQEJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-6-5-10-8-2-3-9-4-7(6)8/h5,9H,2-4H2,1H3.
What are the key properties of 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine has a molecular weight of 153.25 g/mol, XLogP of 1.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine is sourced from PubChem (CID 18377318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).