1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide

C14H21N3O3S — CID 46770903

IUPAC1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H21N3O3S/c1-16(2)21(19,20)17-10-6-7-12(11-17)14(18)15-13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,15,18)
InChIKeyIITYXKHSEIERET-UHFFFAOYSA-N
MW311.41 g/mol
LogP1.14
Rot. Bonds4

About 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide

1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide (PubChem CID 46770903) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide
PubChem CID46770903
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC Name1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)N1CCCC(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H21N3O3S/c1-16(2)21(19,20)17-10-6-7-12(11-17)14(18)15-13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,15,18)
InChIKeyIITYXKHSEIERET-UHFFFAOYSA-N
XLogP1.14
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(dimethylsulfamoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-3-carboxamide
CID 93487555
(3S)-1-(dimethylsulfamoyl)-N-naphthalen-2-ylpiperidine-3-carboxamide
CID 30397988
methyl 4-[[(3R)-1-(dimethylsulfamoyl)piperidine-3-carbonyl]amino]benzoate
CID 94011850
1-(dimethylsulfamoyl)-N-[3-[methyl(methylsulfonyl)amino]phenyl]piperidine-3-carboxamide
CID 43916583
N-(2,6-dimethylphenyl)-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 53283870
(3R)-N-benzyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 39730085
(3S)-1-(dimethylsulfamoyl)-N-(2-methoxyphenyl)piperidine-3-carboxamide
CID 28575034
(3S)-1-(dimethylsulfamoyl)-N-(2-propan-2-ylphenyl)piperidine-3-carboxamide
CID 92681982
(3R)-1-(dimethylsulfamoyl)-N-(2-propan-2-ylphenyl)piperidine-3-carboxamide
CID 92681981
1-(dimethylsulfamoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 133161587
N-(4-bromo-3-chlorophenyl)-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 43905127
(3R)-N-[4-[(3,5-dichlorophenyl)sulfamoyl]phenyl]-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 99939714

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide?
The IUPAC name of 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide (CID 46770903) is 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide?
The canonical SMILES for 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide is CN(C)S(=O)(=O)N1CCCC(C(=O)Nc2ccccc2)C1.
What is the InChIKey of 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide?
The InChIKey is IITYXKHSEIERET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-16(2)21(19,20)17-10-6-7-12(11-17)14(18)15-13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,15,18).
What are the key properties of 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide?
1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide has a molecular weight of 311.41 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 46770903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).