(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide

C9H19N3O3S — CID 94012254

IUPAC(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C9H19N3O3S/c1-10-9(13)8-5-4-6-12(7-8)16(14,15)11(2)3/h8H,4-7H2,1-3H3,(H,10,13)/t8-/m1/s1
InChIKeyWBVBTFANQIMEQN-MRVPVSSYSA-N
MW249.34 g/mol
LogP-0.75
Rot. Bonds3

About (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide

(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide (PubChem CID 94012254) has the molecular formula C9H19N3O3S and a molecular weight of 249.34 g/mol. Its IUPAC name is (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide
PubChem CID94012254
Molecular FormulaC9H19N3O3S
Molecular Weight249.34 g/mol
Exact Mass249.11
IUPAC Name(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C9H19N3O3S/c1-10-9(13)8-5-4-6-12(7-8)16(14,15)11(2)3/h8H,4-7H2,1-3H3,(H,10,13)/t8-/m1/s1
InChIKeyWBVBTFANQIMEQN-MRVPVSSYSA-N
XLogP-0.75
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 5-0.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-cyclopentyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 92686253
N-methyl-1-sulfamoylpiperidine-3-carboxamide
CID 103657393
(3R)-1-(dimethylsulfamoyl)-N,N-dimethylpiperidine-3-carboxamide
CID 92684694
(3S)-1-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]piperidine-3-carboxamide
CID 125074634
(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide
CID 28567035
(3R)-1-(dimethylsulfamoyl)-N-[(2S)-pentan-2-yl]piperidine-3-carboxamide
CID 28958223
(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide
CID 95877591
(3R)-1-(dimethylsulfamoyl)-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 28955789
1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide
CID 46770903
(3S)-1-(dimethylsulfamoyl)-N,N-diethylpiperidine-3-carboxamide
CID 92685694
N-(2,6-dimethylphenyl)-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 53283870
(3R)-1-(dimethylsulfamoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-3-carboxamide
CID 93487555

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide (CID 94012254) is (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide is CNC(=O)[C@@H]1CCCN(S(=O)(=O)N(C)C)C1.
What is the InChIKey of (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is WBVBTFANQIMEQN-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19N3O3S/c1-10-9(13)8-5-4-6-12(7-8)16(14,15)11(2)3/h8H,4-7H2,1-3H3,(H,10,13)/t8-/m1/s1.
What are the key properties of (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide?
(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 249.34 g/mol, XLogP of -0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 94012254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).