N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide

C11H19N3O2S2 — CID 106049183

IUPACN-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide
SMILESCc1nc(CCNS(=O)(=O)C2CCCNC2)cs1
InChIInChI=1S/C11H19N3O2S2/c1-9-14-10(8-17-9)4-6-13-18(15,16)11-3-2-5-12-7-11/h8,11-13H,2-7H2,1H3
InChIKeyFALCJGDMZPITDH-UHFFFAOYSA-N
MW289.43 g/mol
LogP0.67
Rot. Bonds5

About N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide

N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide (PubChem CID 106049183) has the molecular formula C11H19N3O2S2 and a molecular weight of 289.43 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide
PubChem CID106049183
Molecular FormulaC11H19N3O2S2
Molecular Weight289.43 g/mol
Exact Mass289.09
IUPAC NameN-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide
SMILESCc1nc(CCNS(=O)(=O)C2CCCNC2)cs1
InChIInChI=1S/C11H19N3O2S2/c1-9-14-10(8-17-9)4-6-13-18(15,16)11-3-2-5-12-7-11/h8,11-13H,2-7H2,1H3
InChIKeyFALCJGDMZPITDH-UHFFFAOYSA-N
XLogP0.67
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1-pyrrolidin-2-ylmethanesulfonamide
CID 106049173
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-carboxamide
CID 110471916
N-[(6-methyl-2-pyridinyl)methyl]piperidine-3-sulfonamide
CID 62307379
N-[2-(5-bromothiophen-2-yl)ethyl]piperidine-3-sulfonamide
CID 106049253
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119841463
N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide
CID 24699413
N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
3-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-1-sulfonamide
CID 47165000
2-(methylamino)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]ethanesulfonamide
CID 106049175
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidine-3-sulfonamide
CID 106373826
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624601
N-(4,4,4-trifluorobutyl)piperidine-3-sulfonamide
CID 113327829

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide?
The IUPAC name of N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide (CID 106049183) is N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide.
What is the SMILES notation for N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide?
The canonical SMILES for N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide is Cc1nc(CCNS(=O)(=O)C2CCCNC2)cs1.
What is the InChIKey of N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide?
The InChIKey is FALCJGDMZPITDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S2/c1-9-14-10(8-17-9)4-6-13-18(15,16)11-3-2-5-12-7-11/h8,11-13H,2-7H2,1H3.
What are the key properties of N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide?
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide has a molecular weight of 289.43 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide is sourced from PubChem (CID 106049183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).