3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride

C11H26ClN3O2S — CID 119979613

IUPAC3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride
SMILESCCN(CC)S(=O)(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-3-14(4-2)17(15,16)13-9-7-11-6-5-8-12-10-11;/h11-13H,3-10H2,1-2H3;1H
InChIKeyVKAGCUREPFYMIZ-UHFFFAOYSA-N
MW299.87 g/mol
LogP0.97
Rot. Bonds7

About 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride

3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride (PubChem CID 119979613) has the molecular formula C11H26ClN3O2S and a molecular weight of 299.87 g/mol. Its IUPAC name is 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride.

Molecular Properties

Compound Name3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride
PubChem CID119979613
Molecular FormulaC11H26ClN3O2S
Molecular Weight299.87 g/mol
Exact Mass299.14
IUPAC Name3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride
SMILESCCN(CC)S(=O)(=O)NCCC1CCCNC1.Cl
InChIInChI=1S/C11H25N3O2S.ClH/c1-3-14(4-2)17(15,16)13-9-7-11-6-5-8-12-10-11;/h11-13H,3-10H2,1-2H3;1H
InChIKeyVKAGCUREPFYMIZ-UHFFFAOYSA-N
XLogP0.97
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.87
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-piperidin-3-ylethyl)propane-1-sulfonamide;hydrochloride
CID 119979578
N-(2-piperidin-3-ylethyl)propane-1-sulfonamide
CID 60895183
3-[2-[[ethyl(methyl)sulfamoyl]amino]ethyl]pyrrolidine
CID 119977011
2-[2-(diethylsulfamoylamino)ethyl]pyrrolidine
CID 114794250
3-[2-[[benzyl(ethyl)sulfamoyl]amino]ethyl]pyrrolidine
CID 119977245
(3S)-3-(diethylsulfamoylamino)piperidine;hydrochloride
CID 120716789
2-methylsulfonyl-N-(2-piperidin-3-ylethyl)ethanesulfonamide
CID 63245397
N-ethyl-2-[(3S)-piperidin-3-yl]ethanamine
CID 94540790
3-[2-[[cyclopropylmethyl(methyl)sulfamoyl]amino]ethyl]pyrrolidine
CID 119976912
3-[[2-methylpropylsulfamoyl(propyl)amino]methyl]piperidine
CID 106631308
ethyl N-(2-piperidin-3-ylethylsulfamoyl)carbamate
CID 114463242
3-[[methylsulfamoyl(propyl)amino]methyl]piperidine
CID 106631336

Frequently Asked Questions

What is the IUPAC name of 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride?
The IUPAC name of 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride (CID 119979613) is 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride.
What is the SMILES notation for 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride?
The canonical SMILES for 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride is CCN(CC)S(=O)(=O)NCCC1CCCNC1.Cl.
What is the InChIKey of 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride?
The InChIKey is VKAGCUREPFYMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S.ClH/c1-3-14(4-2)17(15,16)13-9-7-11-6-5-8-12-10-11;/h11-13H,3-10H2,1-2H3;1H.
What are the key properties of 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride?
3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride has a molecular weight of 299.87 g/mol, XLogP of 0.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(diethylsulfamoylamino)ethyl]piperidine;hydrochloride is sourced from PubChem (CID 119979613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).