3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide

C11H20N4O3S2 — CID 103365498

IUPAC3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
SMILESCC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CCC1O
InChIInChI=1S/C11H20N4O3S2/c1-7-6-15(5-4-8(7)16)11-9(10(12)13-19-11)20(17,18)14(2)3/h7-8,16H,4-6H2,1-3H3,(H2,12,13)
InChIKeyXGOMPRVZKVQLSH-UHFFFAOYSA-N
MW320.44 g/mol
LogP0.18
Rot. Bonds3

About 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide

3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide (PubChem CID 103365498) has the molecular formula C11H20N4O3S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
PubChem CID103365498
Molecular FormulaC11H20N4O3S2
Molecular Weight320.44 g/mol
Exact Mass320.10
IUPAC Name3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
SMILESCC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CCC1O
InChIInChI=1S/C11H20N4O3S2/c1-7-6-15(5-4-8(7)16)11-9(10(12)13-19-11)20(17,18)14(2)3/h7-8,16H,4-6H2,1-3H3,(H2,12,13)
InChIKeyXGOMPRVZKVQLSH-UHFFFAOYSA-N
XLogP0.18
TPSA99.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-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

3-amino-5-(4-ethylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103361819
3-amino-5-(4-ethoxypiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103360651
3-amino-5-(3-hydroxy-3-methylpyrrolidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103366052
1-(3-amino-4-propan-2-yloxy-1,2-thiazol-5-yl)-3-methylpiperidin-4-ol
CID 103365502
N-[1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)pyrrolidin-3-yl]acetamide
CID 103384147
5-(3,4-dimethylpyrrolidin-1-yl)-4-propylsulfonyl-1,2-thiazol-3-amine
CID 103359090
5-(4-tert-butylpiperidin-1-yl)-4-methylsulfonyl-1,2-thiazol-3-amine
CID 103379610
4-ethylsulfonyl-5-(3-methylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103362141
4-cyclopropylsulfonyl-5-(3-methoxypyrrolidin-1-yl)-1,2-thiazol-3-amine
CID 103542353
ethyl 3-amino-5-(3-hydroxy-4-methylpiperidin-1-yl)-1,2-thiazole-4-carboxylate
CID 103384722
4-methylsulfonyl-5-(3-piperidin-1-ylpyrrolidin-1-yl)-1,2-thiazol-3-amine
CID 103381800
1-(3-amino-4-methylsulfonyl-1,2-thiazol-5-yl)piperidine-3-carboxamide
CID 103381033

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The IUPAC name of 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide (CID 103365498) is 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide.
What is the SMILES notation for 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The canonical SMILES for 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide is CC1CN(c2snc(N)c2S(=O)(=O)N(C)C)CCC1O.
What is the InChIKey of 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
The InChIKey is XGOMPRVZKVQLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3S2/c1-7-6-15(5-4-8(7)16)11-9(10(12)13-19-11)20(17,18)14(2)3/h7-8,16H,4-6H2,1-3H3,(H2,12,13).
What are the key properties of 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide?
3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide has a molecular weight of 320.44 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-(4-hydroxy-3-methylpiperidin-1-yl)-N,N-dimethyl-1,2-thiazole-4-sulfonamide is sourced from PubChem (CID 103365498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).