N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide

C11H22N2O4S — CID 115903015

IUPACN-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NC2(CO)CCC2)CC(C)O1
InChIInChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(15,16)12-11(8-14)4-3-5-11/h9-10,12,14H,3-8H2,1-2H3
InChIKeyVSQFZNNEBWRFHH-UHFFFAOYSA-N
MW278.37 g/mol
LogP-0.16
Rot. Bonds4

About N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide

N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide (PubChem CID 115903015) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide
PubChem CID115903015
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC NameN-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NC2(CO)CCC2)CC(C)O1
InChIInChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(15,16)12-11(8-14)4-3-5-11/h9-10,12,14H,3-8H2,1-2H3
InChIKeyVSQFZNNEBWRFHH-UHFFFAOYSA-N
XLogP-0.16
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(hydroxymethyl)-4-methylcyclohexyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 62525311
N-[1-(hydroxymethyl)-4-methylcyclohexyl]pyrrolidine-1-sulfonamide
CID 62526516
N-[1-(hydroxymethyl)-4-methylcyclohexyl]azepane-1-sulfonamide
CID 62526694
N-[1-(hydroxymethyl)cyclohexyl]morpholine-4-sulfonamide
CID 62520072
N,2,6-trimethylmorpholine-4-sulfonamide
CID 43242358
(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 165470689
N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
CID 43501588
(2R)-2-[(2,6-dimethylmorpholin-4-yl)sulfonylamino]-3-methylbutanoic acid
CID 79010860
N-[2-(aminomethyl)cyclopentyl]-2,6-dimethylmorpholine-4-sulfonamide;hydrochloride
CID 119985507
3-[(2,6-dimethylmorpholin-4-yl)sulfonylamino]-3-methylbutanoic acid
CID 64671370
N-[1-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 62520336
N-butan-2-yl-2,6-dimethylmorpholine-4-sulfonamide
CID 42936366

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide (CID 115903015) is N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide is CC1CN(S(=O)(=O)NC2(CO)CCC2)CC(C)O1.
What is the InChIKey of N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide?
The InChIKey is VSQFZNNEBWRFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(15,16)12-11(8-14)4-3-5-11/h9-10,12,14H,3-8H2,1-2H3.
What are the key properties of N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide?
N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide has a molecular weight of 278.37 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclobutyl]-2,6-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 115903015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).