1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone

C13H19N3OS — CID 82155295

IUPAC1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone
SMILESO=C(Cc1nc2c(s1)CNCC2)N1CCCCC1
InChIInChI=1S/C13H19N3OS/c17-13(16-6-2-1-3-7-16)8-12-15-10-4-5-14-9-11(10)18-12/h14H,1-9H2
InChIKeyMKJMTUFWTDFGQJ-UHFFFAOYSA-N
MW265.38 g/mol
LogP1.34
Rot. Bonds2

About 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone

1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone (PubChem CID 82155295) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone.

Molecular Properties

Compound Name1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone
PubChem CID82155295
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC Name1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone
SMILESO=C(Cc1nc2c(s1)CNCC2)N1CCCCC1
InChIInChI=1S/C13H19N3OS/c17-13(16-6-2-1-3-7-16)8-12-15-10-4-5-14-9-11(10)18-12/h14H,1-9H2
InChIKeyMKJMTUFWTDFGQJ-UHFFFAOYSA-N
XLogP1.34
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone?
The IUPAC name of 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone (CID 82155295) is 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone.
What is the SMILES notation for 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone?
The canonical SMILES for 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone is O=C(Cc1nc2c(s1)CNCC2)N1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone?
The InChIKey is MKJMTUFWTDFGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c17-13(16-6-2-1-3-7-16)8-12-15-10-4-5-14-9-11(10)18-12/h14H,1-9H2.
What are the key properties of 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone?
1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone has a molecular weight of 265.38 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanone is sourced from PubChem (CID 82155295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).