N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide

C13H21N3O2S — CID 106760184

IUPACN-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide
SMILESCN(C)c1ccccc1NS(=O)(=O)C1CCNCC1
InChIInChI=1S/C13H21N3O2S/c1-16(2)13-6-4-3-5-12(13)15-19(17,18)11-7-9-14-10-8-11/h3-6,11,14-15H,7-10H2,1-2H3
InChIKeyJUQQRMUAUODODE-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.25
Rot. Bonds4

About N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide

N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide (PubChem CID 106760184) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide
PubChem CID106760184
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide
SMILESCN(C)c1ccccc1NS(=O)(=O)C1CCNCC1
InChIInChI=1S/C13H21N3O2S/c1-16(2)13-6-4-3-5-12(13)15-19(17,18)11-7-9-14-10-8-11/h3-6,11,14-15H,7-10H2,1-2H3
InChIKeyJUQQRMUAUODODE-UHFFFAOYSA-N
XLogP1.25
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide (CID 106760184) is N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide is CN(C)c1ccccc1NS(=O)(=O)C1CCNCC1.
What is the InChIKey of N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide?
The InChIKey is JUQQRMUAUODODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-16(2)13-6-4-3-5-12(13)15-19(17,18)11-7-9-14-10-8-11/h3-6,11,14-15H,7-10H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide?
N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)phenyl]piperidine-4-sulfonamide is sourced from PubChem (CID 106760184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).