1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide

C16H32N4O3S — CID 69358248

IUPAC1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide
SMILESCN1CCC(N(C)S(=O)(=O)CCCN2CCC(C(N)=O)CC2)CC1
InChIInChI=1S/C16H32N4O3S/c1-18-9-6-15(7-10-18)19(2)24(22,23)13-3-8-20-11-4-14(5-12-20)16(17)21/h14-15H,3-13H2,1-2H3,(H2,17,21)
InChIKeyXWAFLFOSBMOZOB-UHFFFAOYSA-N
MW360.52 g/mol
LogP-0.07
Rot. Bonds7

About 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide

1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide (PubChem CID 69358248) has the molecular formula C16H32N4O3S and a molecular weight of 360.52 g/mol. Its IUPAC name is 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide
PubChem CID69358248
Molecular FormulaC16H32N4O3S
Molecular Weight360.52 g/mol
Exact Mass360.22
IUPAC Name1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide
SMILESCN1CCC(N(C)S(=O)(=O)CCCN2CCC(C(N)=O)CC2)CC1
InChIInChI=1S/C16H32N4O3S/c1-18-9-6-15(7-10-18)19(2)24(22,23)13-3-8-20-11-4-14(5-12-20)16(17)21/h14-15H,3-13H2,1-2H3,(H2,17,21)
InChIKeyXWAFLFOSBMOZOB-UHFFFAOYSA-N
XLogP-0.07
TPSA86.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.52
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(Dipropylamino)propyl]-1-(ethanesulfonyl)piperidine-4-carboxamide
CID 16034200
N-{3-[Butyl(methyl)amino]propyl}-1-(propane-1-sulfonyl)piperidine-4-carboxamide
CID 16034251
N-{3-[Butyl(methyl)amino]propyl}-1-(ethanesulfonyl)piperidine-4-carboxamide
CID 16034201
N-[1-(2-methylpropanoyl)piperidin-4-yl]-1-methylsulfonylpiperidine-4-carboxamide
CID 32583942
N-(2-(2,6-dimethylpiperidin-1-yl)ethyl)-1-(ethylsulfonyl)piperidine-4-carboxamide
CID 3687178
1-butylsulfonyl-N-[1-(2,2-difluoroethyl)piperidin-4-yl]piperidine-4-carboxamide
CID 56217020
N-[2-(2-Methylpiperidin-1-YL)ethyl]-1-(propane-1-sulfonyl)piperidine-4-carboxamide
CID 3328588
N-[3-(2-ethylpiperidin-1-yl)propyl]-1-(methylsulfonyl)piperidine-4-carboxamide
CID 3543761
1-(ethylsulfonyl)-N-[3-(3-methylpiperidin-1-yl)propyl]piperidine-4-carboxamide
CID 3625506
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-1-(ethylsulfonyl)piperidine-4-carboxamide
CID 3636218
N-[3-(2-Ethylpiperidin-1-YL)propyl]-1-(propane-1-sulfonyl)piperidine-4-carboxamide
CID 3686343
N-[3-(2-ethylpiperidin-1-yl)propyl]-1-(ethylsulfonyl)piperidine-4-carboxamide
CID 4066553

Frequently Asked Questions

What is the IUPAC name of 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide?
The IUPAC name of 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide (CID 69358248) is 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide is CN1CCC(N(C)S(=O)(=O)CCCN2CCC(C(N)=O)CC2)CC1.
What is the InChIKey of 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide?
The InChIKey is XWAFLFOSBMOZOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N4O3S/c1-18-9-6-15(7-10-18)19(2)24(22,23)13-3-8-20-11-4-14(5-12-20)16(17)21/h14-15H,3-13H2,1-2H3,(H2,17,21).
What are the key properties of 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide?
1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide has a molecular weight of 360.52 g/mol, XLogP of -0.07, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide is sourced from PubChem (CID 69358248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).