N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide

C9H21NO4S — CID 64585942

IUPACN-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CCCOC)CCOC
InChIInChI=1S/C9H21NO4S/c1-4-15(11,12)10(7-9-14-3)6-5-8-13-2/h4-9H2,1-3H3
InChIKeyOVZIZLLUISYVSM-UHFFFAOYSA-N
MW239.34 g/mol
LogP0.32
Rot. Bonds9

About N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide

N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide (PubChem CID 64585942) has the molecular formula C9H21NO4S and a molecular weight of 239.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide
PubChem CID64585942
Molecular FormulaC9H21NO4S
Molecular Weight239.34 g/mol
Exact Mass239.12
IUPAC NameN-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CCCOC)CCOC
InChIInChI=1S/C9H21NO4S/c1-4-15(11,12)10(7-9-14-3)6-5-8-13-2/h4-9H2,1-3H3
InChIKeyOVZIZLLUISYVSM-UHFFFAOYSA-N
XLogP0.32
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminopropyl)-N-(2-methoxyethyl)butane-1-sulfonamide
CID 63287729
N-(2-cyanoethyl)-N-(2-methoxyethyl)ethanesulfonamide
CID 63286781
N-(2-bromoethyl)-N-butyl-3-methoxypropane-1-sulfonamide
CID 80670145
N-(2-aminoethyl)-N-butyl-2-methoxyethanesulfonamide
CID 63765608
N-(3-aminopropyl)-N-(2-methoxyethyl)-1-methylsulfonylmethanesulfonamide
CID 82839573
N,N-dipentylethanesulfonamide
CID 3453334
3-chloro-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)propane-1-sulfonamide
CID 54877226
N,N-bis(2-ethoxyethyl)ethanesulfonamide
CID 82952267
methyl 3-[2-methoxyethyl-(3-methoxy-3-oxopropyl)sulfonylamino]propanoate
CID 115536179
1-[[2-hydroxyethyl(2-methoxyethyl)sulfamoyl]amino]propane
CID 114809784
2-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzenesulfonamide
CID 61125699
4-(bromomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzenesulfonamide
CID 65481019

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide (CID 64585942) is N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide is CCS(=O)(=O)N(CCCOC)CCOC.
What is the InChIKey of N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide?
The InChIKey is OVZIZLLUISYVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO4S/c1-4-15(11,12)10(7-9-14-3)6-5-8-13-2/h4-9H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide?
N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide has a molecular weight of 239.34 g/mol, XLogP of 0.32, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(3-methoxypropyl)ethanesulfonamide is sourced from PubChem (CID 64585942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).