2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide

C9H15N3O2S2 — CID 103415375

IUPAC2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N[C@H]2CCCNC2)s1
InChIInChI=1S/C9H15N3O2S2/c1-7-11-6-9(15-7)16(13,14)12-8-3-2-4-10-5-8/h6,8,10,12H,2-5H2,1H3/t8-/m0/s1
InChIKeyLJJUTCXSZOHEGI-QMMMGPOBSA-N
MW261.37 g/mol
LogP0.48
Rot. Bonds3

About 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide

2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide (PubChem CID 103415375) has the molecular formula C9H15N3O2S2 and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide
PubChem CID103415375
Molecular FormulaC9H15N3O2S2
Molecular Weight261.37 g/mol
Exact Mass261.06
IUPAC Name2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N[C@H]2CCCNC2)s1
InChIInChI=1S/C9H15N3O2S2/c1-7-11-6-9(15-7)16(13,14)12-8-3-2-4-10-5-8/h6,8,10,12H,2-5H2,1H3/t8-/m0/s1
InChIKeyLJJUTCXSZOHEGI-QMMMGPOBSA-N
XLogP0.48
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

2-methyl-N-piperidin-3-yl-1,3-thiazole-5-sulfonamide
CID 103951401
5-bromo-4-methyl-N-[(3S)-piperidin-3-yl]thiophene-2-sulfonamide
CID 104982659
2-methyl-N-(3-methylcyclopentyl)-1,3-thiazole-5-sulfonamide
CID 105058414
N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
CID 71645820
N-(2-bromocycloheptyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103416113
2,3,4,5,6-pentamethyl-N-[(3R)-piperidin-3-yl]benzenesulfonamide;hydrochloride
CID 120723758
6-methyl-N-piperidin-3-ylpyridazine-3-sulfonamide
CID 71638755
N-(2-aminocyclopropyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103951396
4,5-dimethyl-N-pyrrolidin-3-ylthiophene-2-sulfonamide
CID 84597452
ethyl 5-(piperidin-3-ylsulfamoyl)-1H-pyrazole-4-carboxylate
CID 119964205
5-bromo-4-methyl-N-pyrrolidin-3-ylthiophene-2-sulfonamide
CID 79988606
2,5-dimethyl-3-methylsulfonyl-N-piperidin-3-ylbenzenesulfonamide
CID 119964596

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide (CID 103415375) is 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide is Cc1ncc(S(=O)(=O)N[C@H]2CCCNC2)s1.
What is the InChIKey of 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide?
The InChIKey is LJJUTCXSZOHEGI-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H15N3O2S2/c1-7-11-6-9(15-7)16(13,14)12-8-3-2-4-10-5-8/h6,8,10,12H,2-5H2,1H3/t8-/m0/s1.
What are the key properties of 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide?
2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide has a molecular weight of 261.37 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 103415375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).