7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine

C7H9NS — CID 19009681

IUPAC7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine
SMILESC1=CN2CSC=C2CC1
InChIInChI=1S/C7H9NS/c1-2-4-8-6-9-5-7(8)3-1/h2,4-5H,1,3,6H2
InChIKeyZPXOXDXZBWNXLS-UHFFFAOYSA-N
MW139.22 g/mol
LogP2.14
Rot. Bonds

About 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine

7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine (PubChem CID 19009681) has the molecular formula C7H9NS and a molecular weight of 139.22 g/mol. Its IUPAC name is 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine.

Molecular Properties

Compound Name7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine
PubChem CID19009681
Molecular FormulaC7H9NS
Molecular Weight139.22 g/mol
Exact Mass139.05
IUPAC Name7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine
SMILESC1=CN2CSC=C2CC1
InChIInChI=1S/C7H9NS/c1-2-4-8-6-9-5-7(8)3-1/h2,4-5H,1,3,6H2
InChIKeyZPXOXDXZBWNXLS-UHFFFAOYSA-N
XLogP2.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.22
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine?
The IUPAC name of 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine (CID 19009681) is 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine.
What is the SMILES notation for 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine?
The canonical SMILES for 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine is C1=CN2CSC=C2CC1.
What is the InChIKey of 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine?
The InChIKey is ZPXOXDXZBWNXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NS/c1-2-4-8-6-9-5-7(8)3-1/h2,4-5H,1,3,6H2.
What are the key properties of 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine?
7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine has a molecular weight of 139.22 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-3H-[1,3]thiazolo[3,4-a]pyridine is sourced from PubChem (CID 19009681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).