2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide

C11H24N2O3S — CID 55225682

IUPAC2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide
SMILESCCNCCS(=O)(=O)N(C)CC1CCCOC1
InChIInChI=1S/C11H24N2O3S/c1-3-12-6-8-17(14,15)13(2)9-11-5-4-7-16-10-11/h11-12H,3-10H2,1-2H3
InChIKeyZTEJEBGWHZHZHY-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.28
Rot. Bonds7

About 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide

2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide (PubChem CID 55225682) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide
PubChem CID55225682
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide
SMILESCCNCCS(=O)(=O)N(C)CC1CCCOC1
InChIInChI=1S/C11H24N2O3S/c1-3-12-6-8-17(14,15)13(2)9-11-5-4-7-16-10-11/h11-12H,3-10H2,1-2H3
InChIKeyZTEJEBGWHZHZHY-UHFFFAOYSA-N
XLogP0.28
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.28
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

N-ethyl-N'-methyl-N'-(oxan-3-ylmethyl)ethane-1,2-diamine
CID 63727001
N-methyl-N-(oxan-3-ylmethyl)sulfamoyl chloride
CID 63726478
2-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethanesulfonamide
CID 63274278
N-ethyl-2-(oxan-3-yl)ethanamine
CID 64866831
3-(ethylamino)-N-(oxan-3-ylmethyl)propane-1-sulfonamide
CID 106016480
N-(cyclobutylmethyl)-N-methyl-2-(methylamino)ethanesulfonamide
CID 62854210
1-(3-aminophenyl)-N-methyl-N-(oxan-3-ylmethyl)methanesulfonamide
CID 63725048
N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
CID 175701227
N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
CID 62068860
N'-methyl-N'-(oxan-3-ylmethyl)-N-propylethane-1,2-diamine
CID 63726664
N-ethyl-N',2,2-trimethyl-N'-(oxan-3-ylmethyl)propane-1,3-diamine
CID 63712871
N-methyl-N-(oxan-3-ylmethyl)hydroxylamine
CID 82594564

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide (CID 55225682) is 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide is CCNCCS(=O)(=O)N(C)CC1CCCOC1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide?
The InChIKey is ZTEJEBGWHZHZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-3-12-6-8-17(14,15)13(2)9-11-5-4-7-16-10-11/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide?
2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide has a molecular weight of 264.39 g/mol, XLogP of 0.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)ethanesulfonamide is sourced from PubChem (CID 55225682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).