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

C10H22N2O4S — CID 43501777

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NC(C)(C)CO)CC(C)O1
InChIInChI=1S/C10H22N2O4S/c1-8-5-12(6-9(2)16-8)17(14,15)11-10(3,4)7-13/h8-9,11,13H,5-7H2,1-4H3
InChIKeyKFPDLVWFVCISDB-UHFFFAOYSA-N
MW266.36 g/mol
LogP-0.30
Rot. Bonds4

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

N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide (PubChem CID 43501777) has the molecular formula C10H22N2O4S and a molecular weight of 266.36 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
PubChem CID43501777
Molecular FormulaC10H22N2O4S
Molecular Weight266.36 g/mol
Exact Mass266.13
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NC(C)(C)CO)CC(C)O1
InChIInChI=1S/C10H22N2O4S/c1-8-5-12(6-9(2)16-8)17(14,15)11-10(3,4)7-13/h8-9,11,13H,5-7H2,1-4H3
InChIKeyKFPDLVWFVCISDB-UHFFFAOYSA-N
XLogP-0.30
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide (CID 43501777) is N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide is CC1CN(S(=O)(=O)NC(C)(C)CO)CC(C)O1.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
The InChIKey is KFPDLVWFVCISDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4S/c1-8-5-12(6-9(2)16-8)17(14,15)11-10(3,4)7-13/h8-9,11,13H,5-7H2,1-4H3.
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide?
N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide has a molecular weight of 266.36 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 43501777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).