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

C11H20N4O2S2 — CID 64556893

IUPACN-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide
SMILESCNC(C)c1csc(NS(=O)(=O)N2CCCCC2)n1
InChIInChI=1S/C11H20N4O2S2/c1-9(12-2)10-8-18-11(13-10)14-19(16,17)15-6-4-3-5-7-15/h8-9,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyFUNUTTKBBPKYOP-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.57
Rot. Bonds5

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

N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide (PubChem CID 64556893) has the molecular formula C11H20N4O2S2 and a molecular weight of 304.44 g/mol. Its IUPAC name is N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide
PubChem CID64556893
Molecular FormulaC11H20N4O2S2
Molecular Weight304.44 g/mol
Exact Mass304.10
IUPAC NameN-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide
SMILESCNC(C)c1csc(NS(=O)(=O)N2CCCCC2)n1
InChIInChI=1S/C11H20N4O2S2/c1-9(12-2)10-8-18-11(13-10)14-19(16,17)15-6-4-3-5-7-15/h8-9,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyFUNUTTKBBPKYOP-UHFFFAOYSA-N
XLogP1.57
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide?
The IUPAC name of N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide (CID 64556893) is N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide.
What is the SMILES notation for N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide?
The canonical SMILES for N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide is CNC(C)c1csc(NS(=O)(=O)N2CCCCC2)n1.
What is the InChIKey of N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide?
The InChIKey is FUNUTTKBBPKYOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S2/c1-9(12-2)10-8-18-11(13-10)14-19(16,17)15-6-4-3-5-7-15/h8-9,12H,3-7H2,1-2H3,(H,13,14).
What are the key properties of N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide?
N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide has a molecular weight of 304.44 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]piperidine-1-sulfonamide is sourced from PubChem (CID 64556893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).