N-(2-aminoethyl)-2-ethylsulfanylacetamide

C6H14N2OS — CID 71341315

IUPACN-(2-aminoethyl)-2-ethylsulfanylacetamide
SMILESCCSCC(=O)NCCN
InChIInChI=1S/C6H14N2OS/c1-2-10-5-6(9)8-4-3-7/h2-5,7H2,1H3,(H,8,9)
InChIKeySKRDOARABYBMOA-UHFFFAOYSA-N
MW162.26 g/mol
LogP-0.19
Rot. Bonds5

About N-(2-aminoethyl)-2-ethylsulfanylacetamide

N-(2-aminoethyl)-2-ethylsulfanylacetamide (PubChem CID 71341315) has the molecular formula C6H14N2OS and a molecular weight of 162.26 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-ethylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-ethylsulfanylacetamide
PubChem CID71341315
Molecular FormulaC6H14N2OS
Molecular Weight162.26 g/mol
Exact Mass162.08
IUPAC NameN-(2-aminoethyl)-2-ethylsulfanylacetamide
SMILESCCSCC(=O)NCCN
InChIInChI=1S/C6H14N2OS/c1-2-10-5-6(9)8-4-3-7/h2-5,7H2,1H3,(H,8,9)
InChIKeySKRDOARABYBMOA-UHFFFAOYSA-N
XLogP-0.19
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylsulfanylethyl)acetamide
CID 2245987
Ethanethioic acid, S-(2-(acetylamino)ethyl) ester
CID 14997
N-Acetylthioglycine S-ethyl ester
CID 15553243
Propionic acid, thio-, S-2-(2-aminoacetamido)ethyl ester, hydrobromide
CID 24843809
N-(2-(Acetylsulfanyl)ethyl)-2-aminoethanimidic acid--hydrogen bromide (1/1)
CID 57211
N-glycyl-S-acetylcys-teamine
CID 57212
S-[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]ethyl] ethanethioate
CID 126660
N-{2-[(2-Acetamidoethyl)sulfanyl]ethyl}acetamide
CID 2053712
Glycine, thio-, S-2-acetamidoethyl ester, hydrobromide
CID 59814
N-Carbamoylmethyl-2-isopropylsulfanyl-acetamide
CID 2729293
S-glycyl-N-acetyl-cysteamine
CID 57214
N-(2-((2-Aminoethyl)disulfanyl)ethyl)acetamide
CID 18381305

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-ethylsulfanylacetamide?
The IUPAC name of N-(2-aminoethyl)-2-ethylsulfanylacetamide (CID 71341315) is N-(2-aminoethyl)-2-ethylsulfanylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-ethylsulfanylacetamide?
The canonical SMILES for N-(2-aminoethyl)-2-ethylsulfanylacetamide is CCSCC(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)-2-ethylsulfanylacetamide?
The InChIKey is SKRDOARABYBMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2OS/c1-2-10-5-6(9)8-4-3-7/h2-5,7H2,1H3,(H,8,9).
What are the key properties of N-(2-aminoethyl)-2-ethylsulfanylacetamide?
N-(2-aminoethyl)-2-ethylsulfanylacetamide has a molecular weight of 162.26 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-ethylsulfanylacetamide is sourced from PubChem (CID 71341315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).