3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine

C7H10N2OS — CID 23053807

IUPAC3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine
SMILESCOc1nsc2c1CNCC2
InChIInChI=1S/C7H10N2OS/c1-10-7-5-4-8-3-2-6(5)11-9-7/h8H,2-4H2,1H3
InChIKeyJOGIBFFHENVJCM-UHFFFAOYSA-N
MW170.24 g/mol
LogP0.80
Rot. Bonds1

About 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine

3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine (PubChem CID 23053807) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine
PubChem CID23053807
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC Name3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine
SMILESCOc1nsc2c1CNCC2
InChIInChI=1S/C7H10N2OS/c1-10-7-5-4-8-3-2-6(5)11-9-7/h8H,2-4H2,1H3
InChIKeyJOGIBFFHENVJCM-UHFFFAOYSA-N
XLogP0.80
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine?
The IUPAC name of 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine (CID 23053807) is 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine?
The canonical SMILES for 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine is COc1nsc2c1CNCC2.
What is the InChIKey of 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine?
The InChIKey is JOGIBFFHENVJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c1-10-7-5-4-8-3-2-6(5)11-9-7/h8H,2-4H2,1H3.
What are the key properties of 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine?
3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine has a molecular weight of 170.24 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4,5,6,7-tetrahydro-[1,2]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 23053807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).