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

C13H14N2S — CID 71300285

IUPAC4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
SMILESCc1cccc(C2NCCc3sccc32)n1
InChIInChI=1S/C13H14N2S/c1-9-3-2-4-11(15-9)13-10-6-8-16-12(10)5-7-14-13/h2-4,6,8,13-14H,5,7H2,1H3
InChIKeyMYMCYOHOGNNYBB-UHFFFAOYSA-N
MW230.34 g/mol
LogP2.69
Rot. Bonds1

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

4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine (PubChem CID 71300285) has the molecular formula C13H14N2S and a molecular weight of 230.34 g/mol. Its IUPAC name is 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
PubChem CID71300285
Molecular FormulaC13H14N2S
Molecular Weight230.34 g/mol
Exact Mass230.09
IUPAC Name4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
SMILESCc1cccc(C2NCCc3sccc32)n1
InChIInChI=1S/C13H14N2S/c1-9-3-2-4-11(15-9)13-10-6-8-16-12(10)5-7-14-13/h2-4,6,8,13-14H,5,7H2,1H3
InChIKeyMYMCYOHOGNNYBB-UHFFFAOYSA-N
XLogP2.69
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The IUPAC name of 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine (CID 71300285) is 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine.
What is the SMILES notation for 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The canonical SMILES for 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine is Cc1cccc(C2NCCc3sccc32)n1.
What is the InChIKey of 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
The InChIKey is MYMCYOHOGNNYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2S/c1-9-3-2-4-11(15-9)13-10-6-8-16-12(10)5-7-14-13/h2-4,6,8,13-14H,5,7H2,1H3.
What are the key properties of 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine?
4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine has a molecular weight of 230.34 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-2-pyridinyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine is sourced from PubChem (CID 71300285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).