N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide

C9H21N3O2S — CID 114803152

IUPACN-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide
SMILESCNC(C)C1CCCCN1S(=O)(=O)NC
InChIInChI=1S/C9H21N3O2S/c1-8(10-2)9-6-4-5-7-12(9)15(13,14)11-3/h8-11H,4-7H2,1-3H3
InChIKeyATCHHDZAYYDQSZ-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.09
Rot. Bonds4

About N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide

N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide (PubChem CID 114803152) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide
PubChem CID114803152
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC NameN-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide
SMILESCNC(C)C1CCCCN1S(=O)(=O)NC
InChIInChI=1S/C9H21N3O2S/c1-8(10-2)9-6-4-5-7-12(9)15(13,14)11-3/h8-11H,4-7H2,1-3H3
InChIKeyATCHHDZAYYDQSZ-UHFFFAOYSA-N
XLogP-0.09
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-Cyclohexyl-N-methyl-1-piperazinesulfonamide
CID 16228164
N-((piperidin-2-yl)methyl)methanesulfonamide
CID 18070091
N-[2-(piperidin-2-yl)ethyl]methanesulfonamide
CID 4090533
(3R)-3-amino-N,N-dimethylpiperidine-1-sulfonamide hydrochloride
CID 119031274
2-(aminomethyl)-N,N-dimethylpiperidine-1-sulfonamide hydrochloride
CID 119031489
1-(Piperazine-1-sulfonyl)azepane
CID 2985870
1-[(2-Methylpiperidin-1-yl)sulfonyl]piperazine
CID 16228166
(2S)-N-cycloheptyl-2-methylpiperidine-1-sulfonamide
CID 35295064
N-(piperidin-2-ylmethyl)sulfamide
CID 43810871
2-(aminomethyl)-N,N-dimethylpiperidine-1-sulfonamide
CID 61825786
N-[[(2R)-1-methylpiperidin-2-yl]methyl]pyrrolidine-1-sulfonamide
CID 164642520
(1-Methanesulfonylpiperidin-2-yl)methanamine
CID 59478525

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide?
The IUPAC name of N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide (CID 114803152) is N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide.
What is the SMILES notation for N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide?
The canonical SMILES for N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide is CNC(C)C1CCCCN1S(=O)(=O)NC.
What is the InChIKey of N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide?
The InChIKey is ATCHHDZAYYDQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-8(10-2)9-6-4-5-7-12(9)15(13,14)11-3/h8-11H,4-7H2,1-3H3.
What are the key properties of N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide?
N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide has a molecular weight of 235.35 g/mol, XLogP of -0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(methylamino)ethyl]piperidine-1-sulfonamide is sourced from PubChem (CID 114803152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).