N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide

C11H19N3O3S2 — CID 106630456

IUPACN,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C11H19N3O3S2/c1-8-10(18-11(15)13-8)19(16,17)14(2)7-9-5-3-4-6-12-9/h9,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyOLIBVXPCCWARLZ-UHFFFAOYSA-N
MW305.43 g/mol
LogP0.51
Rot. Bonds4

About N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide

N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide (PubChem CID 106630456) has the molecular formula C11H19N3O3S2 and a molecular weight of 305.43 g/mol. Its IUPAC name is N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide
PubChem CID106630456
Molecular FormulaC11H19N3O3S2
Molecular Weight305.43 g/mol
Exact Mass305.09
IUPAC NameN,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C11H19N3O3S2/c1-8-10(18-11(15)13-8)19(16,17)14(2)7-9-5-3-4-6-12-9/h9,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyOLIBVXPCCWARLZ-UHFFFAOYSA-N
XLogP0.51
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,4-dimethyl-N-(oxan-4-ylmethyl)-2-oxo-3H-1,3-thiazole-5-sulfonamide
CID 63707073
N,1,3,5-tetramethyl-N-(piperidin-2-ylmethyl)pyrazole-4-sulfonamide
CID 106630407
2-chloro-N-methyl-N-(piperidin-2-ylmethyl)benzenesulfonamide
CID 106630491
N,3,5-trimethyl-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106607033
2-fluoro-N,5-dimethyl-N-(piperidin-2-ylmethyl)benzenesulfonamide
CID 106630409
N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630421
4-bromo-2-chloro-N-methyl-N-(piperidin-2-ylmethyl)benzenesulfonamide
CID 106630528
N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630556
5-fluoro-N-methyl-N-(piperidin-2-ylmethyl)pyridine-3-sulfonamide
CID 106630495
N-methyl-N-(piperidin-2-ylmethyl)azepane-1-sulfonamide
CID 106630525
3-chloro-2-fluoro-N-methyl-N-(piperidin-2-ylmethyl)benzenesulfonamide
CID 106630423
N,3,3-trimethyl-N-(piperidin-2-ylmethyl)butane-1-sulfonamide
CID 106630591

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide (CID 106630456) is N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)N(C)CC1CCCCN1.
What is the InChIKey of N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is OLIBVXPCCWARLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S2/c1-8-10(18-11(15)13-8)19(16,17)14(2)7-9-5-3-4-6-12-9/h9,12H,3-7H2,1-2H3,(H,13,15).
What are the key properties of N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide?
N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 305.43 g/mol, XLogP of 0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-oxo-N-(piperidin-2-ylmethyl)-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 106630456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).