5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole

C10H16N2O2S2 — CID 91804318

IUPAC5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole
SMILESCC1CCCC(C)N1S(=O)(=O)c1cncs1
InChIInChI=1S/C10H16N2O2S2/c1-8-4-3-5-9(2)12(8)16(13,14)10-6-11-7-15-10/h6-9H,3-5H2,1-2H3
InChIKeyPUEQQIFZLJTOIW-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.09
Rot. Bonds2

About 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole

5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole (PubChem CID 91804318) has the molecular formula C10H16N2O2S2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole.

Molecular Properties

Compound Name5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole
PubChem CID91804318
Molecular FormulaC10H16N2O2S2
Molecular Weight260.38 g/mol
Exact Mass260.07
IUPAC Name5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole
SMILESCC1CCCC(C)N1S(=O)(=O)c1cncs1
InChIInChI=1S/C10H16N2O2S2/c1-8-4-3-5-9(2)12(8)16(13,14)10-6-11-7-15-10/h6-9H,3-5H2,1-2H3
InChIKeyPUEQQIFZLJTOIW-UHFFFAOYSA-N
XLogP2.09
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Chloro-5-[4-(4-methylpiperidin-1-yl)piperidin-1-yl]sulfonyl-1,3-thiazole
CID 146666615
N,N-Dimethyl-3-[2-(1,3-thiazol-2-YL)piperidin-1-YL]propane-1-sulfonamide
CID 91838272
2-Hexyl-5-thiazole sulfonamide
CID 22406929
5-Bromo-2-(1-propan-2-ylpiperidin-3-yl)sulfonyl-1,3-thiazole
CID 67986562
5-[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonyl-1,3-thiazol-2-amine
CID 87416980
5-(2,6-Dimethylpiperidin-1-yl)sulfonyl-1,3-thiazol-2-amine
CID 87416981
5-Piperidin-1-ylsulfonyl-1,3-thiazole
CID 91052193
5-(4-Methylpiperazin-1-yl)sulfonyl-1,3-thiazole
CID 91064755
2-Bromo-5-piperidin-1-ylsulfonyl-1,3-thiazole
CID 118230762
5-[(3-Ethyl-3,8-diazabicyclo[3.2.1]octan-8-yl)sulfonyl]-2-methyl-1,3-thiazole
CID 129269503
2-Methyl-5-[(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)sulfonyl]-1,3-thiazole
CID 129269723
2-Methyl-5-[(3-propan-2-yl-3,8-diazabicyclo[3.2.1]octan-8-yl)sulfonyl]-1,3-thiazole
CID 137444437

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole?
The IUPAC name of 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole (CID 91804318) is 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole.
What is the SMILES notation for 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole?
The canonical SMILES for 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole is CC1CCCC(C)N1S(=O)(=O)c1cncs1.
What is the InChIKey of 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole?
The InChIKey is PUEQQIFZLJTOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S2/c1-8-4-3-5-9(2)12(8)16(13,14)10-6-11-7-15-10/h6-9H,3-5H2,1-2H3.
What are the key properties of 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole?
5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole has a molecular weight of 260.38 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethylpiperidin-1-yl)sulfonyl-1,3-thiazole is sourced from PubChem (CID 91804318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).