4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide

C11H20N4O2S2 — CID 106061089

IUPAC4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide
SMILESCNCC1CCN(S(=O)(=O)Nc2ncc(C)s2)CC1
InChIInChI=1S/C11H20N4O2S2/c1-9-7-13-11(18-9)14-19(16,17)15-5-3-10(4-6-15)8-12-2/h7,10,12H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyTZLKSWNIEXDGFH-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.04
Rot. Bonds5

About 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide

4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide (PubChem CID 106061089) has the molecular formula C11H20N4O2S2 and a molecular weight of 304.44 g/mol. Its IUPAC name is 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide
PubChem CID106061089
Molecular FormulaC11H20N4O2S2
Molecular Weight304.44 g/mol
Exact Mass304.10
IUPAC Name4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide
SMILESCNCC1CCN(S(=O)(=O)Nc2ncc(C)s2)CC1
InChIInChI=1S/C11H20N4O2S2/c1-9-7-13-11(18-9)14-19(16,17)15-5-3-10(4-6-15)8-12-2/h7,10,12H,3-6,8H2,1-2H3,(H,13,14)
InChIKeyTZLKSWNIEXDGFH-UHFFFAOYSA-N
XLogP1.04
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 ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 106070852
4-(methylaminomethyl)-N-(4-methyl-3-pyridinyl)piperidine-1-sulfonamide
CID 106063201
N-(3-fluoro-5-methylphenyl)-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 106070511
4-(methylaminomethyl)-N-pyridazin-3-ylpiperidine-1-sulfonamide
CID 106084219
4-(methylaminomethyl)-N-(4-methylsulfanylphenyl)piperidine-1-sulfonamide
CID 106057817
N-(3-bromo-4-methylphenyl)-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 106064498
N-(4-fluoro-3-methylphenyl)-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 106056160
N-(3,4-difluorophenyl)-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 106060062
4-(methylaminomethyl)-N-[(2-methylpyrimidin-4-yl)methyl]piperidine-1-sulfonamide
CID 106014232
1-[1-(4,5-dimethylthiophen-2-yl)sulfonylpiperidin-4-yl]-N-methylmethanamine;hydrochloride
CID 86784611
4-(aminomethyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-1-sulfonamide
CID 106082713
N-(cyclobutylmethyl)-5-methyl-1,3-thiazol-2-amine
CID 130741895

Frequently Asked Questions

What is the IUPAC name of 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide?
The IUPAC name of 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide (CID 106061089) is 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide.
What is the SMILES notation for 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide?
The canonical SMILES for 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide is CNCC1CCN(S(=O)(=O)Nc2ncc(C)s2)CC1.
What is the InChIKey of 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide?
The InChIKey is TZLKSWNIEXDGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S2/c1-9-7-13-11(18-9)14-19(16,17)15-5-3-10(4-6-15)8-12-2/h7,10,12H,3-6,8H2,1-2H3,(H,13,14).
What are the key properties of 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide?
4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide has a molecular weight of 304.44 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylaminomethyl)-N-(5-methyl-1,3-thiazol-2-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 106061089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).