N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide

C9H21N3O2S — CID 24699413

IUPACN-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide
SMILESCN(C)CCNS(=O)(=O)C1CCCNC1
InChIInChI=1S/C9H21N3O2S/c1-12(2)7-6-11-15(13,14)9-4-3-5-10-8-9/h9-11H,3-8H2,1-2H3
InChIKeyTVSVOYQWDCKVNB-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.78
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide

N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide (PubChem CID 24699413) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide
PubChem CID24699413
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC NameN-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide
SMILESCN(C)CCNS(=O)(=O)C1CCCNC1
InChIInChI=1S/C9H21N3O2S/c1-12(2)7-6-11-15(13,14)9-4-3-5-10-8-9/h9-11H,3-8H2,1-2H3
InChIKeyTVSVOYQWDCKVNB-UHFFFAOYSA-N
XLogP-0.78
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[ethyl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 62636011
N-[2-[butan-2-yl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 114134808
N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
N-(4,4,4-trifluorobutyl)piperidine-3-sulfonamide
CID 113327829
N-(7-methyloctyl)piperidine-3-sulfonamide
CID 107816777
N-(2-methoxypropyl)piperidine-3-sulfonamide
CID 102699245
N-[2-(5-bromothiophen-2-yl)ethyl]piperidine-3-sulfonamide
CID 106049253
N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide
CID 106402434
N-(3-methylbutyl)pyrrolidine-3-sulfonamide
CID 65421561
(3R)-N-ethylpyrrolidine-3-sulfonamide
CID 96995954
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperidine-3-sulfonamide
CID 106049183
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-3-sulfonamide
CID 63330269

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide (CID 24699413) is N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide is CN(C)CCNS(=O)(=O)C1CCCNC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide?
The InChIKey is TVSVOYQWDCKVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-12(2)7-6-11-15(13,14)9-4-3-5-10-8-9/h9-11H,3-8H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide?
N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide has a molecular weight of 235.35 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide is sourced from PubChem (CID 24699413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).