(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide

C9H20N2O3S — CID 165470689

IUPAC(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)NS(=O)(=O)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C9H20N2O3S/c1-7(2)10-15(12,13)11-5-8(3)14-9(4)6-11/h7-10H,5-6H2,1-4H3/t8-,9+
InChIKeyKTNDBCVIIYVBLF-DTORHVGOSA-N
MW236.34 g/mol
LogP0.34
Rot. Bonds3

About (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide

(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide (PubChem CID 165470689) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide.

Molecular Properties

Compound Name(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
PubChem CID165470689
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)NS(=O)(=O)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C9H20N2O3S/c1-7(2)10-15(12,13)11-5-8(3)14-9(4)6-11/h7-10H,5-6H2,1-4H3/t8-,9+
InChIKeyKTNDBCVIIYVBLF-DTORHVGOSA-N
XLogP0.34
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2,6-dimethylmorpholine-4-sulfonamide
CID 42936366
2-methyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 110631373
(2R)-2-[(2,6-dimethylmorpholin-4-yl)sulfonylamino]-3-methylbutanoic acid
CID 79010860
N,2,6-trimethylmorpholine-4-sulfonamide
CID 43242358
N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
CID 43501588
N-(2-amino-1-cyclohexylethyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 115309357
(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide
CID 51930251
N-(3-hydroxybutyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 64911850
N-(3-aminobutyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 55167597
(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide
CID 100845308
(2S,6S)-N-[2-[di(propan-2-yl)amino]ethyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 94607055
2,6-dimethyl-N-[1-(1H-pyrazol-4-yl)ethyl]morpholine-4-sulfonamide
CID 103854198

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide?
The IUPAC name of (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide (CID 165470689) is (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide.
What is the SMILES notation for (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide?
The canonical SMILES for (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide is CC(C)NS(=O)(=O)N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide?
The InChIKey is KTNDBCVIIYVBLF-DTORHVGOSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-7(2)10-15(12,13)11-5-8(3)14-9(4)6-11/h7-10H,5-6H2,1-4H3/t8-,9+.
What are the key properties of (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide?
(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide has a molecular weight of 236.34 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide is sourced from PubChem (CID 165470689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).