N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide

C12H24N2O3S — CID 119052630

IUPACN-(1-piperidin-3-ylethyl)oxane-3-sulfonamide
SMILESCC(NS(=O)(=O)C1CCCOC1)C1CCCNC1
InChIInChI=1S/C12H24N2O3S/c1-10(11-4-2-6-13-8-11)14-18(15,16)12-5-3-7-17-9-12/h10-14H,2-9H2,1H3
InChIKeyGKMXYMXNKMKPSN-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.47
Rot. Bonds4

About N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide

N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide (PubChem CID 119052630) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide.

Molecular Properties

Compound NameN-(1-piperidin-3-ylethyl)oxane-3-sulfonamide
PubChem CID119052630
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-(1-piperidin-3-ylethyl)oxane-3-sulfonamide
SMILESCC(NS(=O)(=O)C1CCCOC1)C1CCCNC1
InChIInChI=1S/C12H24N2O3S/c1-10(11-4-2-6-13-8-11)14-18(15,16)12-5-3-7-17-9-12/h10-14H,2-9H2,1H3
InChIKeyGKMXYMXNKMKPSN-UHFFFAOYSA-N
XLogP0.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yloxane-3-sulfonamide
CID 130684869
N-(3-methylpiperidin-4-yl)oxane-3-sulfonamide
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(3R)-N-propan-2-yloxolane-3-sulfonamide
CID 97175132
N-(1-piperidin-3-ylethyl)piperidine-1-sulfonamide
CID 43523454
2-(1-piperidin-3-ylethylsulfamoyl)propanoic acid
CID 62047248
N-methyloxane-3-sulfonamide
CID 69039393
N-(1-piperidin-3-ylethyl)butane-1-sulfonamide
CID 43523463
1-(oxan-2-yl)-N-(1-piperidin-3-ylethyl)methanesulfonamide;hydrochloride
CID 119970218
oxan-3-yl(piperidin-3-yl)methanol
CID 107135650
N-(1-piperidin-3-ylethyl)furan-2-sulfonamide
CID 120874778
N-(oxan-3-yl)-3-piperidin-3-ylbutanamide
CID 81043949
N-(1-piperidin-3-ylethyl)-1,4-dioxane-2-carboxamide;hydrochloride
CID 119260227

Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide?
The IUPAC name of N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide (CID 119052630) is N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide.
What is the SMILES notation for N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide?
The canonical SMILES for N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide is CC(NS(=O)(=O)C1CCCOC1)C1CCCNC1.
What is the InChIKey of N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide?
The InChIKey is GKMXYMXNKMKPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-10(11-4-2-6-13-8-11)14-18(15,16)12-5-3-7-17-9-12/h10-14H,2-9H2,1H3.
What are the key properties of N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide?
N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide has a molecular weight of 276.40 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-3-ylethyl)oxane-3-sulfonamide is sourced from PubChem (CID 119052630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).