2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide

C10H22N2O5S — CID 170359453

IUPAC2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
SMILESCNCCOCC(=O)NCCOCCS(C)(=O)=O
InChIInChI=1S/C10H22N2O5S/c1-11-3-5-17-9-10(13)12-4-6-16-7-8-18(2,14)15/h11H,3-9H2,1-2H3,(H,12,13)
InChIKeyHPIWGOGMWWHPNZ-UHFFFAOYSA-N
MW282.36 g/mol
LogP-1.60
Rot. Bonds11

About 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide

2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide (PubChem CID 170359453) has the molecular formula C10H22N2O5S and a molecular weight of 282.36 g/mol. Its IUPAC name is 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
PubChem CID170359453
Molecular FormulaC10H22N2O5S
Molecular Weight282.36 g/mol
Exact Mass282.12
IUPAC Name2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
SMILESCNCCOCC(=O)NCCOCCS(C)(=O)=O
InChIInChI=1S/C10H22N2O5S/c1-11-3-5-17-9-10(13)12-4-6-16-7-8-18(2,14)15/h11H,3-9H2,1-2H3,(H,12,13)
InChIKeyHPIWGOGMWWHPNZ-UHFFFAOYSA-N
XLogP-1.60
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 5-1.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-pentoxy-N-[2-(trifluoromethylsulfonyl)ethyl]acetamide
CID 126830091
1,10-Dioxa-4-thia-7,13-diazacyclopentadecane-3,6,14-trione
CID 559433
1,4,10-Trioxa-13-thia-7,16-diazacyclooctadecane-8,12,15-trione
CID 588387
N-[2-(2-ethenylsulfonylethoxy)ethyl]acetamide
CID 58907722
2-(2-Acetamidoethoxy)ethanesulfonate
CID 59247715
4,4-Dioxo-1-oxa-4lambda6,7-dithia-10-azacyclododecan-11-one
CID 60095535
2-Propan-2-ylsulfonylmorpholin-3-one
CID 70183122
2-[(2-Ethoxyacetyl)amino]ethanesulfonic acid
CID 88968468
2-[(2-Methoxyacetyl)amino]ethanesulfinate
CID 89323027
N-ethylacetamide;N-(2-methoxyethyl)acetamide;methylsulfonylmethane
CID 142083509
3-[[2-(2-Ethoxyethoxy)acetyl]amino]propyl-dimethyl-(3-methylsulfonylpropyl)azanium
CID 148468398
3-[3-[[2-(2-Ethoxyethoxy)acetyl]amino]propyl-dimethylazaniumyl]propane-1-sulfonate
CID 153279828

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide?
The IUPAC name of 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide (CID 170359453) is 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide.
What is the SMILES notation for 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide?
The canonical SMILES for 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide is CNCCOCC(=O)NCCOCCS(C)(=O)=O.
What is the InChIKey of 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide?
The InChIKey is HPIWGOGMWWHPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O5S/c1-11-3-5-17-9-10(13)12-4-6-16-7-8-18(2,14)15/h11H,3-9H2,1-2H3,(H,12,13).
What are the key properties of 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide?
2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide has a molecular weight of 282.36 g/mol, XLogP of -1.60, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide is sourced from PubChem (CID 170359453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).