N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide

C10H17N3O2S2 — CID 54972609

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide
SMILESCc1nc(NS(=O)(=O)C2CCCNC2)sc1C
InChIInChI=1S/C10H17N3O2S2/c1-7-8(2)16-10(12-7)13-17(14,15)9-4-3-5-11-6-9/h9,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyFWRFBZOGYKHPTO-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.25
Rot. Bonds3

About N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide (PubChem CID 54972609) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide
PubChem CID54972609
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide
SMILESCc1nc(NS(=O)(=O)C2CCCNC2)sc1C
InChIInChI=1S/C10H17N3O2S2/c1-7-8(2)16-10(12-7)13-17(14,15)9-4-3-5-11-6-9/h9,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyFWRFBZOGYKHPTO-UHFFFAOYSA-N
XLogP1.25
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide (CID 54972609) is N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide is Cc1nc(NS(=O)(=O)C2CCCNC2)sc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide?
The InChIKey is FWRFBZOGYKHPTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c1-7-8(2)16-10(12-7)13-17(14,15)9-4-3-5-11-6-9/h9,11H,3-6H2,1-2H3,(H,12,13).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide has a molecular weight of 275.40 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)piperidine-3-sulfonamide is sourced from PubChem (CID 54972609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).