3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine

C10H15NS — CID 130621119

IUPAC3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
SMILESCC(C)C1=CSC2=CCCCN21
InChIInChI=1S/C10H15NS/c1-8(2)9-7-12-10-5-3-4-6-11(9)10/h5,7-8H,3-4,6H2,1-2H3
InChIKeyAHINAISGSRLVPO-UHFFFAOYSA-N
MW181.30 g/mol
LogP3.17
Rot. Bonds1

About 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine

3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine (PubChem CID 130621119) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine.

Molecular Properties

Compound Name3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
PubChem CID130621119
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
SMILESCC(C)C1=CSC2=CCCCN21
InChIInChI=1S/C10H15NS/c1-8(2)9-7-12-10-5-3-4-6-11(9)10/h5,7-8H,3-4,6H2,1-2H3
InChIKeyAHINAISGSRLVPO-UHFFFAOYSA-N
XLogP3.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The IUPAC name of 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine (CID 130621119) is 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine.
What is the SMILES notation for 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The canonical SMILES for 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine is CC(C)C1=CSC2=CCCCN21.
What is the InChIKey of 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The InChIKey is AHINAISGSRLVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c1-8(2)9-7-12-10-5-3-4-6-11(9)10/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine has a molecular weight of 181.30 g/mol, XLogP of 3.17, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine is sourced from PubChem (CID 130621119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).