3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride

C13H22ClN3O3S2 — CID 119461586

IUPAC3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccsc1C(=O)NCC1CCCNC1.Cl
InChIInChI=1S/C13H21N3O3S2.ClH/c1-16(2)21(18,19)11-5-7-20-12(11)13(17)15-9-10-4-3-6-14-8-10;/h5,7,10,14H,3-4,6,8-9H2,1-2H3,(H,15,17);1H
InChIKeyMHLKEECFWMYDAL-UHFFFAOYSA-N
MW367.92 g/mol
LogP1.15
Rot. Bonds5

About 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride

3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride (PubChem CID 119461586) has the molecular formula C13H22ClN3O3S2 and a molecular weight of 367.92 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
PubChem CID119461586
Molecular FormulaC13H22ClN3O3S2
Molecular Weight367.92 g/mol
Exact Mass367.08
IUPAC Name3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
SMILESCN(C)S(=O)(=O)c1ccsc1C(=O)NCC1CCCNC1.Cl
InChIInChI=1S/C13H21N3O3S2.ClH/c1-16(2)21(18,19)11-5-7-20-12(11)13(17)15-9-10-4-3-6-14-8-10;/h5,7,10,14H,3-4,6,8-9H2,1-2H3,(H,15,17);1H
InChIKeyMHLKEECFWMYDAL-UHFFFAOYSA-N
XLogP1.15
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.92
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride 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-(dimethylsulfamoyl)-N-(2-pyrrolidin-3-ylethyl)thiophene-2-carboxamide
CID 119535146
3-methyl-N-(pyrrolidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 71638244
3-(dimethylsulfamoyl)-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide;hydrochloride
CID 120556996
3-(dimethylsulfamoyl)-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 120556997
4-methyl-N-(piperidin-3-ylmethyl)-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119459915
2-N,2-N-dimethyl-1-N-(piperidin-3-ylmethyl)benzene-1,2-disulfonamide;hydrochloride
CID 120707833
3-[methyl(propan-2-yl)sulfamoyl]-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462288
3-(dimethylsulfamoyl)-N-(3-piperazin-1-ylpropyl)thiophene-2-carboxamide;hydrochloride
CID 119392093
4-(dimethylamino)-N-(piperidin-3-ylmethyl)benzamide
CID 43329219
2-[benzenesulfonyl(methyl)amino]-N-(piperidin-3-ylmethyl)acetamide
CID 119459953
4-[2-(dimethylamino)-2-oxoethyl]sulfonyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119463409
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride (CID 119461586) is 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride is CN(C)S(=O)(=O)c1ccsc1C(=O)NCC1CCCNC1.Cl.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is MHLKEECFWMYDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3S2.ClH/c1-16(2)21(18,19)11-5-7-20-12(11)13(17)15-9-10-4-3-6-14-8-10;/h5,7,10,14H,3-4,6,8-9H2,1-2H3,(H,15,17);1H.
What are the key properties of 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride?
3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 367.92 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(piperidin-3-ylmethyl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119461586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).