N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide

C8H18N2O3S — CID 43807754

IUPACN-[2-(2-ethylsulfonylethylamino)ethyl]acetamide
SMILESCCS(=O)(=O)CCNCCNC(C)=O
InChIInChI=1S/C8H18N2O3S/c1-3-14(12,13)7-6-9-4-5-10-8(2)11/h9H,3-7H2,1-2H3,(H,10,11)
InChIKeyCFWAJDHETGHIAZ-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.85
Rot. Bonds7

About N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide

N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide (PubChem CID 43807754) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-ethylsulfonylethylamino)ethyl]acetamide
PubChem CID43807754
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC NameN-[2-(2-ethylsulfonylethylamino)ethyl]acetamide
SMILESCCS(=O)(=O)CCNCCNC(C)=O
InChIInChI=1S/C8H18N2O3S/c1-3-14(12,13)7-6-9-4-5-10-8(2)11/h9H,3-7H2,1-2H3,(H,10,11)
InChIKeyCFWAJDHETGHIAZ-UHFFFAOYSA-N
XLogP-0.85
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-propylsulfonylethylamino)ethyl]acetamide
CID 106723232
N-[2-[2-[2-[2-(ethylamino)ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 88534902
N-(2-propylsulfonylethyl)acetamide
CID 142065321
N-[2-(ethylamino)ethyl]acetamide;propane
CID 159314545
2-(2-ethylsulfonylethylamino)ethanol
CID 43807737
N-[4-(4-acetamidobutylamino)butyl]acetamide
CID 10332037
4-(2-acetamidoethylsulfonyl)butanamide
CID 90011139
N,N-diethyl-3-(2-ethylsulfonylethylamino)propanamide
CID 112695679
N-[2-[4-(3-aminopropylamino)butylamino]ethyl]acetamide
CID 59687521
N-(2-ethylsulfonylethyl)-3-methylbut-2-en-1-amine
CID 106547093
N-[2-[3-[dihydroxy(methyl)silyl]propylamino]ethyl]acetamide
CID 102052869
N-[2-(3-propoxypropylamino)ethyl]acetamide
CID 107529829

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide?
The IUPAC name of N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide (CID 43807754) is N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide?
The canonical SMILES for N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide is CCS(=O)(=O)CCNCCNC(C)=O.
What is the InChIKey of N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide?
The InChIKey is CFWAJDHETGHIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-3-14(12,13)7-6-9-4-5-10-8(2)11/h9H,3-7H2,1-2H3,(H,10,11).
What are the key properties of N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide?
N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide has a molecular weight of 222.31 g/mol, XLogP of -0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylsulfonylethylamino)ethyl]acetamide is sourced from PubChem (CID 43807754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).