N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane

C5H15NO3S — CID 143602059

IUPACN-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane
SMILESCC.CC(=O)NS(C)(O)O
InChIInChI=1S/C3H9NO3S.C2H6/c1-3(5)4-8(2,6)7;1-2/h6-7H,1-2H3,(H,4,5);1-2H3
InChIKeyGQFGQYJDLZRFBY-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.44
Rot. Bonds1

About N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane

N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane (PubChem CID 143602059) has the molecular formula C5H15NO3S and a molecular weight of 169.25 g/mol. Its IUPAC name is N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane.

Molecular Properties

Compound NameN-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane
PubChem CID143602059
Molecular FormulaC5H15NO3S
Molecular Weight169.25 g/mol
Exact Mass169.08
IUPAC NameN-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane
SMILESCC.CC(=O)NS(C)(O)O
InChIInChI=1S/C3H9NO3S.C2H6/c1-3(5)4-8(2,6)7;1-2/h6-7H,1-2H3,(H,4,5);1-2H3
InChIKeyGQFGQYJDLZRFBY-UHFFFAOYSA-N
XLogP1.44
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[amino(dihydroxy)-λ4-sulfanyl]acetamide;ethane
CID 168951364
ethane;methanesulfonic acid
CID 87194848
N-acetylsulfamoyl chloride
CID 21043699
methanesulfonic acid;methyl acetate
CID 172690689
N-methylsulfanylsulfonylacetamide
CID 163498610
benzene;ethane;methanesulfonic acid;methyl acetate
CID 161432944
N-propan-2-ylsulfonylacetamide
CID 18730103
methanesulfonic acid;stibane
CID 173129060
methanesulfonic acid;hydrate
CID 87278985
CID 87129852
CID 87129852
hydron;methanesulfonic acid
CID 19767432
CID 72786756
CID 72786756

Frequently Asked Questions

What is the IUPAC name of N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane?
The IUPAC name of N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane (CID 143602059) is N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane.
What is the SMILES notation for N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane?
The canonical SMILES for N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane is CC.CC(=O)NS(C)(O)O.
What is the InChIKey of N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane?
The InChIKey is GQFGQYJDLZRFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO3S.C2H6/c1-3(5)4-8(2,6)7;1-2/h6-7H,1-2H3,(H,4,5);1-2H3.
What are the key properties of N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane?
N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane has a molecular weight of 169.25 g/mol, XLogP of 1.44, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dihydroxy(methyl)-λ4-sulfanyl]acetamide;ethane is sourced from PubChem (CID 143602059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).