N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide

C8H18N2O4S — CID 61487766

IUPACN-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide
SMILESCOCCNC(=O)CNCCS(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-14-5-3-10-8(11)7-9-4-6-15(2,12)13/h9H,3-7H2,1-2H3,(H,10,11)
InChIKeyPOYUURJEGPFOPX-UHFFFAOYSA-N
MW238.31 g/mol
LogP-1.62
Rot. Bonds8

About N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide

N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide (PubChem CID 61487766) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide
PubChem CID61487766
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide
SMILESCOCCNC(=O)CNCCS(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-14-5-3-10-8(11)7-9-4-6-15(2,12)13/h9H,3-7H2,1-2H3,(H,10,11)
InChIKeyPOYUURJEGPFOPX-UHFFFAOYSA-N
XLogP-1.62
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-1.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(2-Methylsulfonylacetyl)amino]acetamide
CID 61688142
N'-(2-methylsulfonylethyl)oxamide
CID 90229220
N-(2-methoxyethyl)acetamide;N-[2-(methylamino)ethyl]acetamide;N-(2-methylsulfonylethyl)acetamide;propane
CID 142083460
N-ethylacetamide;N-(2-methoxyethyl)acetamide;methylsulfonylmethane
CID 142083509
N-[2-(dimethylamino)ethyl]-N-methylacetamide;N-(2-methoxyethyl)-N-methylacetamide;N-methyl-N-[2-(methylamino)ethyl]acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide
CID 158534614
N-(2-methoxyethyl)acetamide;N-methyl-N-(2-methylsulfonylethyl)acetamide
CID 159189227
2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
CID 170359453
2-[2-(dimethylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
CID 170359456
N-methyl-2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
CID 170359457
2-[4-(2-Acetamidoethyl)morpholin-4-ium-4-yl]ethanesulfonate
CID 176697898
(2-(Propane-2-sulfonyl)-acetylamino)-acetic acid ethyl ester
CID 4670529
2-amino-N-(1-methoxypropan-2-yl)-4-methylsulfonylbutanamide
CID 24692776

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide (CID 61487766) is N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide is COCCNC(=O)CNCCS(C)(=O)=O.
What is the InChIKey of N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide?
The InChIKey is POYUURJEGPFOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-14-5-3-10-8(11)7-9-4-6-15(2,12)13/h9H,3-7H2,1-2H3,(H,10,11).
What are the key properties of N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide?
N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide has a molecular weight of 238.31 g/mol, XLogP of -1.62, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(2-methylsulfonylethylamino)acetamide is sourced from PubChem (CID 61487766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).