N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide

C9H16N2O4S — CID 60700799

IUPACN-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
SMILESCONC(=O)CSCC(=O)N1CCOCC1
InChIInChI=1S/C9H16N2O4S/c1-14-10-8(12)6-16-7-9(13)11-2-4-15-5-3-11/h2-7H2,1H3,(H,10,12)
InChIKeyJFMQIKPGIXDXBT-UHFFFAOYSA-N
MW248.30 g/mol
LogP-0.74
Rot. Bonds5

About N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide

N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide (PubChem CID 60700799) has the molecular formula C9H16N2O4S and a molecular weight of 248.30 g/mol. Its IUPAC name is N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide.

Molecular Properties

Compound NameN-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
PubChem CID60700799
Molecular FormulaC9H16N2O4S
Molecular Weight248.30 g/mol
Exact Mass248.08
IUPAC NameN-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
SMILESCONC(=O)CSCC(=O)N1CCOCC1
InChIInChI=1S/C9H16N2O4S/c1-14-10-8(12)6-16-7-9(13)11-2-4-15-5-3-11/h2-7H2,1H3,(H,10,12)
InChIKeyJFMQIKPGIXDXBT-UHFFFAOYSA-N
XLogP-0.74
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 43388901
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 103895247
N-[(2R)-1-hydroxypropan-2-yl]-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 79031362
2-hydroxy-2-methyl-3-[[2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetyl]amino]propanoic acid
CID 66173764
N-(2-hydroxy-3-methylbutyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 115701598
N-[(2R)-1-hydroxybutan-2-yl]-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 103920035
N-(2-chloroprop-2-enyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 113238668
2-(methoxyamino)-1-morpholin-4-ylethanone
CID 60702997
2-(2-amino-2-methylpropyl)sulfanyl-1-morpholin-4-ylethanone
CID 66231125
(2S)-2-hydroxy-3-[[2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetyl]amino]propanoic acid
CID 107833509
2-hydroxy-3-[[2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetyl]amino]propanoic acid
CID 66167023
N-(5-hydroxypentyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 107318984

Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide?
The IUPAC name of N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide (CID 60700799) is N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide.
What is the SMILES notation for N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide?
The canonical SMILES for N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide is CONC(=O)CSCC(=O)N1CCOCC1.
What is the InChIKey of N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide?
The InChIKey is JFMQIKPGIXDXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4S/c1-14-10-8(12)6-16-7-9(13)11-2-4-15-5-3-11/h2-7H2,1H3,(H,10,12).
What are the key properties of N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide?
N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide has a molecular weight of 248.30 g/mol, XLogP of -0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide is sourced from PubChem (CID 60700799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).