N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide

C9H20N2O4S — CID 43574633

IUPACN-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)N(CCO)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H20N2O4S/c1-9(2)11(3-6-12)16(13,14)10-4-7-15-8-5-10/h9,12H,3-8H2,1-2H3
InChIKeyXMCKXYCILKVOMP-UHFFFAOYSA-N
MW252.34 g/mol
LogP-0.73
Rot. Bonds5

About N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide

N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide (PubChem CID 43574633) has the molecular formula C9H20N2O4S and a molecular weight of 252.34 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide
PubChem CID43574633
Molecular FormulaC9H20N2O4S
Molecular Weight252.34 g/mol
Exact Mass252.11
IUPAC NameN-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)N(CCO)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H20N2O4S/c1-9(2)11(3-6-12)16(13,14)10-4-7-15-8-5-10/h9,12H,3-8H2,1-2H3
InChIKeyXMCKXYCILKVOMP-UHFFFAOYSA-N
XLogP-0.73
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N,2-dimethyl-N-(propan-2-yl)morpholine-4-sulfonamide
CID 51946497
(2R)-N,2-dimethyl-N-(propan-2-yl)morpholine-4-sulfonamide
CID 51946496
N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-methylsulfamate
CID 3123587
[4-[2-[Tert-butyl(dimethylsulfamoyl)amino]ethyl]morpholin-3-yl]methanol
CID 59831566
N-methyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 60714196
[4-[2-[Dimethylsulfamoyl(ethyl)amino]ethyl]morpholin-3-yl]methanol
CID 70804217
2-[Morpholin-4-ylsulfanyl(propyl)amino]ethanol
CID 154932103
Ethanol;4-methylmorpholin-4-ium-4-sulfonate
CID 172716550
Methyl hydrogen sulfate;4-methyl-4-propan-2-ylmorpholin-4-ium
CID 429494
N-ethyl-N-[2-hydroxy-3-[(2-hydroxy-3-morpholin-4-ylpropyl)-methylamino]propyl]sulfamate
CID 3104960
4-Methyl-4-propan-2-ylmorpholin-4-ium;methyl sulfate
CID 24197270
N-(1-hydroxybutan-2-yl)morpholine-4-sulfonamide
CID 43501767

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide (CID 43574633) is N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide is CC(C)N(CCO)S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide?
The InChIKey is XMCKXYCILKVOMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4S/c1-9(2)11(3-6-12)16(13,14)10-4-7-15-8-5-10/h9,12H,3-8H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide?
N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide has a molecular weight of 252.34 g/mol, XLogP of -0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide is sourced from PubChem (CID 43574633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).