N-methylsulfonylmorpholine-3-carboxamide

C6H12N2O4S — CID 103287575

IUPACN-methylsulfonylmorpholine-3-carboxamide
SMILESCS(=O)(=O)NC(=O)C1COCCN1
InChIInChI=1S/C6H12N2O4S/c1-13(10,11)8-6(9)5-4-12-3-2-7-5/h5,7H,2-4H2,1H3,(H,8,9)
InChIKeyGEZUWPRUWUPKER-UHFFFAOYSA-N
MW208.24 g/mol
LogP-1.95
Rot. Bonds2

About N-methylsulfonylmorpholine-3-carboxamide

N-methylsulfonylmorpholine-3-carboxamide (PubChem CID 103287575) has the molecular formula C6H12N2O4S and a molecular weight of 208.24 g/mol. Its IUPAC name is N-methylsulfonylmorpholine-3-carboxamide.

Molecular Properties

Compound NameN-methylsulfonylmorpholine-3-carboxamide
PubChem CID103287575
Molecular FormulaC6H12N2O4S
Molecular Weight208.24 g/mol
Exact Mass208.05
IUPAC NameN-methylsulfonylmorpholine-3-carboxamide
SMILESCS(=O)(=O)NC(=O)C1COCCN1
InChIInChI=1S/C6H12N2O4S/c1-13(10,11)8-6(9)5-4-12-3-2-7-5/h5,7H,2-4H2,1H3,(H,8,9)
InChIKeyGEZUWPRUWUPKER-UHFFFAOYSA-N
XLogP-1.95
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 5-1.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
ethane;morpholine-3-carboxylic acid
CID 144576497
methyl (3S)-morpholine-3-carboxylate;hydrochloride
CID 42614245
N-[(2R)-1-hydroxypropan-2-yl]morpholine-3-carboxamide
CID 107218691
N-(4-hydroxybutan-2-yl)morpholine-3-carboxamide
CID 83177558
(2R)-3-hydroxy-2-(morpholine-3-carbonylamino)propanoic acid
CID 80750560
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]morpholine-3-carboxamide
CID 107852767
(3S)-morpholine-3-carboxylic acid;hydrochloride
CID 42614332
N-[2-(propan-2-ylsulfamoyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119758877
1-morpholin-3-ylpropan-1-one
CID 54487560
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide
CID 103811312

Frequently Asked Questions

What is the IUPAC name of N-methylsulfonylmorpholine-3-carboxamide?
The IUPAC name of N-methylsulfonylmorpholine-3-carboxamide (CID 103287575) is N-methylsulfonylmorpholine-3-carboxamide.
What is the SMILES notation for N-methylsulfonylmorpholine-3-carboxamide?
The canonical SMILES for N-methylsulfonylmorpholine-3-carboxamide is CS(=O)(=O)NC(=O)C1COCCN1.
What is the InChIKey of N-methylsulfonylmorpholine-3-carboxamide?
The InChIKey is GEZUWPRUWUPKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O4S/c1-13(10,11)8-6(9)5-4-12-3-2-7-5/h5,7H,2-4H2,1H3,(H,8,9).
What are the key properties of N-methylsulfonylmorpholine-3-carboxamide?
N-methylsulfonylmorpholine-3-carboxamide has a molecular weight of 208.24 g/mol, XLogP of -1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylsulfonylmorpholine-3-carboxamide is sourced from PubChem (CID 103287575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).