N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide

C11H20N2O3S — CID 54972545

IUPACN-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide
SMILESCCNCCS(=O)(=O)N(CC)Cc1ccco1
InChIInChI=1S/C11H20N2O3S/c1-3-12-7-9-17(14,15)13(4-2)10-11-6-5-8-16-11/h5-6,8,12H,3-4,7,9-10H2,1-2H3
InChIKeyWFFFEWGYFUGXIJ-UHFFFAOYSA-N
MW260.36 g/mol
LogP1.04
Rot. Bonds8

About N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide

N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide (PubChem CID 54972545) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide
PubChem CID54972545
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC NameN-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide
SMILESCCNCCS(=O)(=O)N(CC)Cc1ccco1
InChIInChI=1S/C11H20N2O3S/c1-3-12-7-9-17(14,15)13(4-2)10-11-6-5-8-16-11/h5-6,8,12H,3-4,7,9-10H2,1-2H3
InChIKeyWFFFEWGYFUGXIJ-UHFFFAOYSA-N
XLogP1.04
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 51.04
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

3-chloro-N-ethyl-N-(furan-2-ylmethyl)propane-1-sulfonamide
CID 60958479
N-ethyl-2-(ethylamino)-N-(thiophen-2-ylmethyl)ethanesulfonamide
CID 54972047
3-[ethylsulfonyl(furan-2-ylmethyl)amino]propanoic acid
CID 50894680
3-[butylsulfonyl(furan-2-ylmethyl)amino]propanoic acid
CID 82326435
N-(furan-2-ylmethyl)-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 64585550
4-amino-N-ethyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 61105124
3-amino-N-ethyl-N-(furan-2-ylmethyl)-2,6-dimethylbenzenesulfonamide
CID 61105127
4-(bromomethyl)-N-ethyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 65480815
N-ethyl-2-[2-[[ethyl(furan-2-ylmethyl)amino]methyl]phenyl]ethanamine
CID 115463985
5-amino-4-bromo-N-ethyl-2-fluoro-N-(furan-2-ylmethyl)benzenesulfonamide
CID 116529898
5-chloro-N-ethyl-N-(furan-2-ylmethyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64606165
3-(aminomethyl)-N-ethyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 61423669

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide?
The IUPAC name of N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide (CID 54972545) is N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide.
What is the SMILES notation for N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide?
The canonical SMILES for N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide is CCNCCS(=O)(=O)N(CC)Cc1ccco1.
What is the InChIKey of N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide?
The InChIKey is WFFFEWGYFUGXIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-3-12-7-9-17(14,15)13(4-2)10-11-6-5-8-16-11/h5-6,8,12H,3-4,7,9-10H2,1-2H3.
What are the key properties of N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide?
N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide has a molecular weight of 260.36 g/mol, XLogP of 1.04, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(ethylamino)-N-(furan-2-ylmethyl)ethanesulfonamide is sourced from PubChem (CID 54972545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).