(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide

C15H17N3O3S2 — CID 164638502

IUPAC(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide
SMILESNS(=O)(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)ns2)C1
InChIInChI=1S/C15H17N3O3S2/c16-23(20,21)12-7-4-8-18(10-12)15(19)14-9-13(17-22-14)11-5-2-1-3-6-11/h1-3,5-6,9,12H,4,7-8,10H2,(H2,16,20,21)/t12-/m0/s1
InChIKeyBRSYPFYHOUFFDN-LBPRGKRZSA-N
MW351.45 g/mol
LogP1.70
Rot. Bonds3

About (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide

(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide (PubChem CID 164638502) has the molecular formula C15H17N3O3S2 and a molecular weight of 351.45 g/mol. Its IUPAC name is (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide
PubChem CID164638502
Molecular FormulaC15H17N3O3S2
Molecular Weight351.45 g/mol
Exact Mass351.07
IUPAC Name(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide
SMILESNS(=O)(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)ns2)C1
InChIInChI=1S/C15H17N3O3S2/c16-23(20,21)12-7-4-8-18(10-12)15(19)14-9-13(17-22-14)11-5-2-1-3-6-11/h1-3,5-6,9,12H,4,7-8,10H2,(H2,16,20,21)/t12-/m0/s1
InChIKeyBRSYPFYHOUFFDN-LBPRGKRZSA-N
XLogP1.70
TPSA93.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-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 (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide?
The IUPAC name of (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide (CID 164638502) is (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide?
The canonical SMILES for (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide is NS(=O)(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)ns2)C1.
What is the InChIKey of (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide?
The InChIKey is BRSYPFYHOUFFDN-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H17N3O3S2/c16-23(20,21)12-7-4-8-18(10-12)15(19)14-9-13(17-22-14)11-5-2-1-3-6-11/h1-3,5-6,9,12H,4,7-8,10H2,(H2,16,20,21)/t12-/m0/s1.
What are the key properties of (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide?
(3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide has a molecular weight of 351.45 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(3-phenyl-1,2-thiazole-5-carbonyl)piperidine-3-sulfonamide is sourced from PubChem (CID 164638502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).