N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide

C15H23N3O3S — CID 119943618

IUPACN-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1
InChIInChI=1S/C15H23N3O3S/c1-15(8-5-9-16-11-15)14(19)17-12-6-4-7-13(10-12)22(20,21)18(2)3/h4,6-7,10,16H,5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyACCHIFSJKCEAEH-UHFFFAOYSA-N
MW325.43 g/mol
LogP1.27
Rot. Bonds4

About N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide

N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide (PubChem CID 119943618) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide
PubChem CID119943618
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1
InChIInChI=1S/C15H23N3O3S/c1-15(8-5-9-16-11-15)14(19)17-12-6-4-7-13(10-12)22(20,21)18(2)3/h4,6-7,10,16H,5,8-9,11H2,1-3H3,(H,17,19)
InChIKeyACCHIFSJKCEAEH-UHFFFAOYSA-N
XLogP1.27
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
CID 63130562
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
N-(3-imidazol-1-ylphenyl)-3-methylpiperidine-3-carboxamide
CID 63130122
3-ethyl-N-(3-sulfamoylphenyl)piperidine-3-carboxamide
CID 63132301
N-(4-chloro-3-fluorophenyl)-3-methylpiperidine-3-carboxamide
CID 63130654
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119943991
3-methyl-N-[3-(tetrazol-1-yl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119943848
1-[3-(dimethylsulfamoyl)phenyl]-3-(3,5,7-trimethyl-1-adamantyl)urea
CID 3599813
N-[4-(hydroxymethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 113397758
3-methyl-N-[4-(methylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 63131065

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide (CID 119943618) is N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide is CN(C)S(=O)(=O)c1cccc(NC(=O)C2(C)CCCNC2)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide?
The InChIKey is ACCHIFSJKCEAEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-15(8-5-9-16-11-15)14(19)17-12-6-4-7-13(10-12)22(20,21)18(2)3/h4,6-7,10,16H,5,8-9,11H2,1-3H3,(H,17,19).
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide?
N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide has a molecular weight of 325.43 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-3-methylpiperidine-3-carboxamide is sourced from PubChem (CID 119943618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).