8aH-[1,3]thiazolo[3,2-a]pyridine

C7H7NS — CID 57187348

IUPAC8aH-[1,3]thiazolo[3,2-a]pyridine
SMILESC1=CC2SC=CN2C=C1
InChIInChI=1S/C7H7NS/c1-2-4-8-5-6-9-7(8)3-1/h1-7H
InChIKeyHBDWCWHZUHCRPZ-UHFFFAOYSA-N
MW137.21 g/mol
LogP1.92
Rot. Bonds

About 8aH-[1,3]thiazolo[3,2-a]pyridine

8aH-[1,3]thiazolo[3,2-a]pyridine (PubChem CID 57187348) has the molecular formula C7H7NS and a molecular weight of 137.21 g/mol. Its IUPAC name is 8aH-[1,3]thiazolo[3,2-a]pyridine.

Molecular Properties

Compound Name8aH-[1,3]thiazolo[3,2-a]pyridine
PubChem CID57187348
Molecular FormulaC7H7NS
Molecular Weight137.21 g/mol
Exact Mass137.03
IUPAC Name8aH-[1,3]thiazolo[3,2-a]pyridine
SMILESC1=CC2SC=CN2C=C1
InChIInChI=1S/C7H7NS/c1-2-4-8-5-6-9-7(8)3-1/h1-7H
InChIKeyHBDWCWHZUHCRPZ-UHFFFAOYSA-N
XLogP1.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.21
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8aH-[1,3]thiazolo[3,2-a]pyridine?
The IUPAC name of 8aH-[1,3]thiazolo[3,2-a]pyridine (CID 57187348) is 8aH-[1,3]thiazolo[3,2-a]pyridine.
What is the SMILES notation for 8aH-[1,3]thiazolo[3,2-a]pyridine?
The canonical SMILES for 8aH-[1,3]thiazolo[3,2-a]pyridine is C1=CC2SC=CN2C=C1.
What is the InChIKey of 8aH-[1,3]thiazolo[3,2-a]pyridine?
The InChIKey is HBDWCWHZUHCRPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NS/c1-2-4-8-5-6-9-7(8)3-1/h1-7H.
What are the key properties of 8aH-[1,3]thiazolo[3,2-a]pyridine?
8aH-[1,3]thiazolo[3,2-a]pyridine has a molecular weight of 137.21 g/mol, XLogP of 1.92, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8aH-[1,3]thiazolo[3,2-a]pyridine is sourced from PubChem (CID 57187348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).