(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide

C12H25N3O3S — CID 28567035

IUPAC(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C12H25N3O3S/c1-10(2)8-13-12(16)11-6-5-7-15(9-11)19(17,18)14(3)4/h10-11H,5-9H2,1-4H3,(H,13,16)/t11-/m1/s1
InChIKeyGJLLXQTZISHOJY-LLVKDONJSA-N
MW291.42 g/mol
LogP0.28
Rot. Bonds5

About (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide

(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide (PubChem CID 28567035) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide
PubChem CID28567035
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC Name(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide
SMILESCC(C)CNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C12H25N3O3S/c1-10(2)8-13-12(16)11-6-5-7-15(9-11)19(17,18)14(3)4/h10-11H,5-9H2,1-4H3,(H,13,16)/t11-/m1/s1
InChIKeyGJLLXQTZISHOJY-LLVKDONJSA-N
XLogP0.28
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(dimethylsulfamoyl)-N-[(2S)-pentan-2-yl]piperidine-3-carboxamide
CID 28958223
(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide
CID 94012254
1-(dimethylsulfamoyl)-N-[2-(2-methylpropylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 132984866
(3S)-1-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]piperidine-3-carboxamide
CID 125074634
(3R)-1-(dimethylsulfamoyl)-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 28955789
(3R)-N-cyclopentyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 92686253
(3R)-N-benzyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 39730085
(3R)-1-(4-fluorophenyl)sulfonyl-N-(2-methylpropyl)piperidine-3-carboxamide
CID 27539403
N-[(2R)-2-hydroxypropyl]-1-methylsulfonylpiperidine-3-carboxamide
CID 83031962
(3R)-1-(dimethylsulfamoyl)-N,N-dimethylpiperidine-3-carboxamide
CID 92684694
(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide
CID 95877591
(3R)-1-(dimethylsulfamoyl)-N-[(1S)-3-methyl-1-phenylbutyl]piperidine-3-carboxamide
CID 30379738

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide (CID 28567035) is (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide is CC(C)CNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1.
What is the InChIKey of (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide?
The InChIKey is GJLLXQTZISHOJY-LLVKDONJSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-10(2)8-13-12(16)11-6-5-7-15(9-11)19(17,18)14(3)4/h10-11H,5-9H2,1-4H3,(H,13,16)/t11-/m1/s1.
What are the key properties of (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide?
(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide has a molecular weight of 291.42 g/mol, XLogP of 0.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide is sourced from PubChem (CID 28567035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).