5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine

C15H25N3OS — CID 52941318

IUPAC5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine
SMILESCN1CCc2sc(OCCCN3CCCCC3)nc2C1
InChIInChI=1S/C15H25N3OS/c1-17-10-6-14-13(12-17)16-15(20-14)19-11-5-9-18-7-3-2-4-8-18/h2-12H2,1H3
InChIKeyJMPPTODNHHWTMD-UHFFFAOYSA-N
MW295.45 g/mol
LogP2.39
Rot. Bonds5

About 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine

5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 52941318) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine
PubChem CID52941318
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC Name5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine
SMILESCN1CCc2sc(OCCCN3CCCCC3)nc2C1
InChIInChI=1S/C15H25N3OS/c1-17-10-6-14-13(12-17)16-15(20-14)19-11-5-9-18-7-3-2-4-8-18/h2-12H2,1H3
InChIKeyJMPPTODNHHWTMD-UHFFFAOYSA-N
XLogP2.39
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 59463861
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CID 59463927
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CID 59630960
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CID 68251418
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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine (CID 52941318) is 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine is CN1CCc2sc(OCCCN3CCCCC3)nc2C1.
What is the InChIKey of 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is JMPPTODNHHWTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-17-10-6-14-13(12-17)16-15(20-14)19-11-5-9-18-7-3-2-4-8-18/h2-12H2,1H3.
What are the key properties of 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine?
5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 295.45 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-piperidin-1-ylpropoxy)-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 52941318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).