N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide

C10H22N2O4S — CID 43501588

IUPACN-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCCC(CO)NS(=O)(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C10H22N2O4S/c1-4-10(7-13)11-17(14,15)12-5-8(2)16-9(3)6-12/h8-11,13H,4-7H2,1-3H3
InChIKeyWIFALUDWUNARBY-UHFFFAOYSA-N
MW266.36 g/mol
LogP-0.30
Rot. Bonds5

About N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide

N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide (PubChem CID 43501588) has the molecular formula C10H22N2O4S and a molecular weight of 266.36 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
PubChem CID43501588
Molecular FormulaC10H22N2O4S
Molecular Weight266.36 g/mol
Exact Mass266.13
IUPAC NameN-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCCC(CO)NS(=O)(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C10H22N2O4S/c1-4-10(7-13)11-17(14,15)12-5-8(2)16-9(3)6-12/h8-11,13H,4-7H2,1-3H3
InChIKeyWIFALUDWUNARBY-UHFFFAOYSA-N
XLogP-0.30
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide (CID 43501588) is N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide is CCC(CO)NS(=O)(=O)N1CC(C)OC(C)C1.
What is the InChIKey of N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The InChIKey is WIFALUDWUNARBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4S/c1-4-10(7-13)11-17(14,15)12-5-8(2)16-9(3)6-12/h8-11,13H,4-7H2,1-3H3.
What are the key properties of N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide has a molecular weight of 266.36 g/mol, XLogP of -0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 43501588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).