N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide

C12H26N2O4S — CID 79386614

IUPACN-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C12H26N2O4S/c1-6-13(9-12(4,5)15)19(16,17)14-7-10(2)18-11(3)8-14/h10-11,15H,6-9H2,1-5H3
InChIKeyFPEVTVKCZMMNRG-UHFFFAOYSA-N
MW294.42 g/mol
LogP0.43
Rot. Bonds5

About N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide

N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide (PubChem CID 79386614) has the molecular formula C12H26N2O4S and a molecular weight of 294.42 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide
PubChem CID79386614
Molecular FormulaC12H26N2O4S
Molecular Weight294.42 g/mol
Exact Mass294.16
IUPAC NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C12H26N2O4S/c1-6-13(9-12(4,5)15)19(16,17)14-7-10(2)18-11(3)8-14/h10-11,15H,6-9H2,1-5H3
InChIKeyFPEVTVKCZMMNRG-UHFFFAOYSA-N
XLogP0.43
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-N,2,6-trimethylmorpholine-4-sulfonamide
CID 79386593
(2S,6R)-N,N,2,6-tetramethylmorpholine-4-sulfonamide
CID 884474
N,N-diethyl-3-hydroxyazetidine-1-sulfonamide
CID 63106993
2-[[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-methylamino]acetamide
CID 94061320
N-[2-(diethylsulfamoyl)ethyl]-2,6-dimethylmorpholine-4-carboxamide
CID 56782565
N-(2-aminoethyl)-N,2,6-trimethylmorpholine-4-sulfonamide
CID 62688438
2,6-dimethyl-N,N-bis(thiophen-2-ylmethyl)morpholine-4-sulfonamide
CID 51331024
2-[cyclopropyl-(2,6-dimethylmorpholin-4-yl)sulfonylamino]acetic acid
CID 54945247
N-(2-hydroxy-2-methylpropyl)-N,4-dimethylpiperidine-1-sulfonamide
CID 79388046
2,6-dimethyl-4-(tribromomethylsulfonyl)morpholine
CID 21445275
(2R,6R)-N-(cyclohexylmethyl)-2,6-dimethyl-N-prop-2-enylmorpholine-4-sulfonamide
CID 99807354
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 79387072

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide?
The IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide (CID 79386614) is N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide is CCN(CC(C)(C)O)S(=O)(=O)N1CC(C)OC(C)C1.
What is the InChIKey of N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide?
The InChIKey is FPEVTVKCZMMNRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O4S/c1-6-13(9-12(4,5)15)19(16,17)14-7-10(2)18-11(3)8-14/h10-11,15H,6-9H2,1-5H3.
What are the key properties of N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide?
N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide has a molecular weight of 294.42 g/mol, XLogP of 0.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxy-2-methylpropyl)-2,6-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 79386614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).