N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide

C11H24N2O4S — CID 86989323

IUPACN-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide
SMILESCOCCOCCNS(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C11H24N2O4S/c1-11-4-3-6-13(10-11)18(14,15)12-5-7-17-9-8-16-2/h11-12H,3-10H2,1-2H3
InChIKeyYHGYDTLFUUVPIF-UHFFFAOYSA-N
MW280.39 g/mol
LogP0.22
Rot. Bonds8

About N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide

N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide (PubChem CID 86989323) has the molecular formula C11H24N2O4S and a molecular weight of 280.39 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide
PubChem CID86989323
Molecular FormulaC11H24N2O4S
Molecular Weight280.39 g/mol
Exact Mass280.15
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide
SMILESCOCCOCCNS(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C11H24N2O4S/c1-11-4-3-6-13(10-11)18(14,15)12-5-7-17-9-8-16-2/h11-12H,3-10H2,1-2H3
InChIKeyYHGYDTLFUUVPIF-UHFFFAOYSA-N
XLogP0.22
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(3S)-N-(2-methoxyethyl)-3-methylpiperidine-1-sulfonamide
CID 94063829
3-methyl-N-[2-[(3-methylpiperidin-1-yl)sulfonylamino]ethyl]piperidine-1-sulfonamide
CID 46595803
methyl 2-[(3-methylpiperidin-1-yl)sulfonylamino]acetate
CID 43431574
(3S)-1-(2-methoxyethylsulfamoyl)piperidine-3-carboxylic acid
CID 104978646
3-acetyl-N-(2-methoxyethyl)piperidine-1-sulfonamide
CID 114815332
N-(2-methoxyethyl)azetidine-1-sulfonamide
CID 164583733
N-[2-(cycloheptylamino)ethyl]-3-methylpiperidine-1-sulfonamide;hydrochloride
CID 119987333
N-(6-bromohexyl)-3-methylpiperidine-1-sulfonamide
CID 107848876
methyl 2-methyl-3-[(3-methylpiperidin-1-yl)sulfonylamino]propanoate
CID 71847849
(3R)-N-[2-(4-methoxyphenyl)ethyl]-3-methylpiperidine-1-sulfonamide
CID 35431016
(3S)-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 95141775
(3S)-3-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-1-sulfonamide
CID 39992415

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide (CID 86989323) is N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide is COCCOCCNS(=O)(=O)N1CCCC(C)C1.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide?
The InChIKey is YHGYDTLFUUVPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4S/c1-11-4-3-6-13(10-11)18(14,15)12-5-7-17-9-8-16-2/h11-12H,3-10H2,1-2H3.
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide?
N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide has a molecular weight of 280.39 g/mol, XLogP of 0.22, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 86989323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).