3-amino-N,N-diethylpiperidine-1-sulfonamide

C9H21N3O2S — CID 43210480

IUPAC3-amino-N,N-diethylpiperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCCC(N)C1
InChIInChI=1S/C9H21N3O2S/c1-3-11(4-2)15(13,14)12-7-5-6-9(10)8-12/h9H,3-8,10H2,1-2H3
InChIKeyMBXYIXVTNTWPJE-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.00
Rot. Bonds4

About 3-amino-N,N-diethylpiperidine-1-sulfonamide

3-amino-N,N-diethylpiperidine-1-sulfonamide (PubChem CID 43210480) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is 3-amino-N,N-diethylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name3-amino-N,N-diethylpiperidine-1-sulfonamide
PubChem CID43210480
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC Name3-amino-N,N-diethylpiperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCCC(N)C1
InChIInChI=1S/C9H21N3O2S/c1-3-11(4-2)15(13,14)12-7-5-6-9(10)8-12/h9H,3-8,10H2,1-2H3
InChIKeyMBXYIXVTNTWPJE-UHFFFAOYSA-N
XLogP-0.00
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N,N-diethyl-3-hydroxypiperidine-1-sulfonamide
CID 107225076
3-(1-aminoethyl)-N,N-diethylpiperidine-1-sulfonamide
CID 63854361
(3R)-3-aminopiperidine-1-sulfonamide
CID 102984338
3-amino-N-butyl-N-methylpiperidine-1-sulfonamide;hydrochloride
CID 119959504
1-propylsulfonylpiperidin-3-amine;hydrochloride
CID 119959785
2-amino-N,N-diethylazepane-1-sulfonamide
CID 64560720
(3S)-N,N-diethyl-3-hydroxypyrrolidine-1-sulfonamide
CID 79031251
3-(chloromethyl)-N-ethyl-N-(2-methylbutyl)piperidine-1-sulfonamide
CID 79470564
N-(3-aminopropyl)-N-ethyl-3-methylpiperidine-1-sulfonamide
CID 43136910
2-[1-(diethylsulfamoyl)piperidin-3-yl]-2-methylpropanoic acid
CID 83198043
3-amino-N-propylpiperidine-1-sulfonamide
CID 114803216
(3R)-1-cyclopropylsulfonylpiperidin-3-amine
CID 95378411

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N-diethylpiperidine-1-sulfonamide?
The IUPAC name of 3-amino-N,N-diethylpiperidine-1-sulfonamide (CID 43210480) is 3-amino-N,N-diethylpiperidine-1-sulfonamide.
What is the SMILES notation for 3-amino-N,N-diethylpiperidine-1-sulfonamide?
The canonical SMILES for 3-amino-N,N-diethylpiperidine-1-sulfonamide is CCN(CC)S(=O)(=O)N1CCCC(N)C1.
What is the InChIKey of 3-amino-N,N-diethylpiperidine-1-sulfonamide?
The InChIKey is MBXYIXVTNTWPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-3-11(4-2)15(13,14)12-7-5-6-9(10)8-12/h9H,3-8,10H2,1-2H3.
What are the key properties of 3-amino-N,N-diethylpiperidine-1-sulfonamide?
3-amino-N,N-diethylpiperidine-1-sulfonamide has a molecular weight of 235.35 g/mol, XLogP of -0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-diethylpiperidine-1-sulfonamide is sourced from PubChem (CID 43210480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).