1,2-diethylpiperidine-4-sulfonamide

C9H20N2O2S — CID 170189847

IUPAC1,2-diethylpiperidine-4-sulfonamide
SMILESCCC1CC(S(N)(=O)=O)CCN1CC
InChIInChI=1S/C9H20N2O2S/c1-3-8-7-9(14(10,12)13)5-6-11(8)4-2/h8-9H,3-7H2,1-2H3,(H2,10,12,13)
InChIKeyUBRVBSUSPLIKGZ-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.54
Rot. Bonds3

About 1,2-diethylpiperidine-4-sulfonamide

1,2-diethylpiperidine-4-sulfonamide (PubChem CID 170189847) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is 1,2-diethylpiperidine-4-sulfonamide.

Molecular Properties

Compound Name1,2-diethylpiperidine-4-sulfonamide
PubChem CID170189847
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC Name1,2-diethylpiperidine-4-sulfonamide
SMILESCCC1CC(S(N)(=O)=O)CCN1CC
InChIInChI=1S/C9H20N2O2S/c1-3-8-7-9(14(10,12)13)5-6-11(8)4-2/h8-9H,3-7H2,1-2H3,(H2,10,12,13)
InChIKeyUBRVBSUSPLIKGZ-UHFFFAOYSA-N
XLogP0.54
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 19604037
4,5-diethyl-1,4-oxazepane
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1-(1-ethylpiperidin-4-yl)pyrrolidine-3-sulfonamide
CID 137403169
[(2S,4R)-1-ethyl-4-methylpiperidin-2-yl]methanol
CID 145404764
(1S,5R)-8-azabicyclo[3.2.1]octane-3-sulfonamide;(1S,5R)-8-ethyl-8-azabicyclo[3.2.1]octane-3-sulfonamide;hydrochloride
CID 157221928
1-(azetidin-3-yl)piperidine-4-sulfonamide;1-(1-ethylazetidin-3-yl)piperidine-4-sulfonamide;dihydrochloride
CID 159120920
3-(1-ethylpyrrolidin-2-yl)propan-1-amine
CID 63763897
2-ethyl-1-methylsulfonylazetidine
CID 130668579
(2R)-2-ethyl-1-ethylsulfonylazetidine
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1-ethyl-2-(methoxymethyl)azetidine
CID 123419729

Frequently Asked Questions

What is the IUPAC name of 1,2-diethylpiperidine-4-sulfonamide?
The IUPAC name of 1,2-diethylpiperidine-4-sulfonamide (CID 170189847) is 1,2-diethylpiperidine-4-sulfonamide.
What is the SMILES notation for 1,2-diethylpiperidine-4-sulfonamide?
The canonical SMILES for 1,2-diethylpiperidine-4-sulfonamide is CCC1CC(S(N)(=O)=O)CCN1CC.
What is the InChIKey of 1,2-diethylpiperidine-4-sulfonamide?
The InChIKey is UBRVBSUSPLIKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-3-8-7-9(14(10,12)13)5-6-11(8)4-2/h8-9H,3-7H2,1-2H3,(H2,10,12,13).
What are the key properties of 1,2-diethylpiperidine-4-sulfonamide?
1,2-diethylpiperidine-4-sulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethylpiperidine-4-sulfonamide is sourced from PubChem (CID 170189847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).