(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide

C13H22N2O4S — CID 51930251

IUPAC(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide
SMILESCc1ccc([C@H](C)NS(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)o1
InChIInChI=1S/C13H22N2O4S/c1-9-5-6-13(19-9)12(4)14-20(16,17)15-7-10(2)18-11(3)8-15/h5-6,10-12,14H,7-8H2,1-4H3/t10-,11-,12+/m1/s1
InChIKeySWZWOXWAGFGKAJ-UTUOFQBUSA-N
MW302.40 g/mol
LogP1.59
Rot. Bonds4

About (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide

(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide (PubChem CID 51930251) has the molecular formula C13H22N2O4S and a molecular weight of 302.40 g/mol. Its IUPAC name is (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide.

Molecular Properties

Compound Name(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide
PubChem CID51930251
Molecular FormulaC13H22N2O4S
Molecular Weight302.40 g/mol
Exact Mass302.13
IUPAC Name(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide
SMILESCc1ccc([C@H](C)NS(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)o1
InChIInChI=1S/C13H22N2O4S/c1-9-5-6-13(19-9)12(4)14-20(16,17)15-7-10(2)18-11(3)8-15/h5-6,10-12,14H,7-8H2,1-4H3/t10-,11-,12+/m1/s1
InChIKeySWZWOXWAGFGKAJ-UTUOFQBUSA-N
XLogP1.59
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide with MolForge

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Related Compounds

N-[(1S)-1-(5-methylfuran-2-yl)ethyl]azepane-1-sulfonamide
CID 30288270
(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 165470689
N-butan-2-yl-2,6-dimethylmorpholine-4-sulfonamide
CID 42936366
2,6-dimethyl-N-[1-(1H-pyrazol-4-yl)ethyl]morpholine-4-sulfonamide
CID 103854198
2-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]piperidine-1-sulfonamide
CID 106003416
(2R)-2-[(2,6-dimethylmorpholin-4-yl)sulfonylamino]-3-methylbutanoic acid
CID 79010860
N-(2-hydroxy-1-phenylethyl)-2,6-dimethylmorpholine-4-sulfonamide
CID 63182703
N,2,6-trimethylmorpholine-4-sulfonamide
CID 43242358
(2R)-2-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylamino]-2-phenylacetamide
CID 100851411
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 36700403
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 36700400
2,6-dimethyl-N-[4-(methylamino)phenyl]morpholine-4-sulfonamide
CID 43604137

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide?
The IUPAC name of (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide (CID 51930251) is (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide.
What is the SMILES notation for (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide?
The canonical SMILES for (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide is Cc1ccc([C@H](C)NS(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)o1.
What is the InChIKey of (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide?
The InChIKey is SWZWOXWAGFGKAJ-UTUOFQBUSA-N. The full InChI is InChI=1S/C13H22N2O4S/c1-9-5-6-13(19-9)12(4)14-20(16,17)15-7-10(2)18-11(3)8-15/h5-6,10-12,14H,7-8H2,1-4H3/t10-,11-,12+/m1/s1.
What are the key properties of (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide?
(2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide has a molecular weight of 302.40 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2,6-dimethyl-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]morpholine-4-sulfonamide is sourced from PubChem (CID 51930251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).