3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide

C14H21N3O3S — CID 63130562

IUPAC3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
SMILESCNS(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1
InChIInChI=1S/C14H21N3O3S/c1-14(7-4-8-16-10-14)13(18)17-11-5-3-6-12(9-11)21(19,20)15-2/h3,5-6,9,15-16H,4,7-8,10H2,1-2H3,(H,17,18)
InChIKeyCVNRWWYBKZJURP-UHFFFAOYSA-N
MW311.41 g/mol
LogP0.92
Rot. Bonds4

About 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide

3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide (PubChem CID 63130562) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
PubChem CID63130562
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC Name3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
SMILESCNS(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1
InChIInChI=1S/C14H21N3O3S/c1-14(7-4-8-16-10-14)13(18)17-11-5-3-6-12(9-11)21(19,20)15-2/h3,5-6,9,15-16H,4,7-8,10H2,1-2H3,(H,17,18)
InChIKeyCVNRWWYBKZJURP-UHFFFAOYSA-N
XLogP0.92
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 119943618
N-(3-chlorophenyl)-3-methylpiperidine-3-carboxamide
CID 63132655
N-(3-acetylphenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943623
3-methyl-N-(3-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119943872
1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119293957
3-ethyl-N-(3-sulfamoylphenyl)piperidine-3-carboxamide
CID 63132301
1-methyl-N-[3-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]cyclohexane-1-carboxamide
CID 3263192
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 63131065
3-methyl-N-pyridin-4-ylpiperidine-3-carboxamide;dihydrochloride
CID 119946059
N-(4-acetamidophenyl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943521
N-(3-imidazol-1-ylphenyl)-3-methylpiperidine-3-carboxamide
CID 63130122
N-(4-chloro-3-fluorophenyl)-3-methylpiperidine-3-carboxamide
CID 63130654

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide?
The IUPAC name of 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide (CID 63130562) is 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide is CNS(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1.
What is the InChIKey of 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide?
The InChIKey is CVNRWWYBKZJURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-14(7-4-8-16-10-14)13(18)17-11-5-3-6-12(9-11)21(19,20)15-2/h3,5-6,9,15-16H,4,7-8,10H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide?
3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide has a molecular weight of 311.41 g/mol, XLogP of 0.92, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 63130562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).