2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine

C4H14N2O2S — CID 145135290

IUPAC2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine
SMILESCN(C)S(O)(O)CCN
InChIInChI=1S/C4H14N2O2S/c1-6(2)9(7,8)4-3-5/h7-8H,3-5H2,1-2H3
InChIKeyHSRLDWNLOIWNGL-UHFFFAOYSA-N
MW154.24 g/mol
LogP0.17
Rot. Bonds3

About 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine

2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine (PubChem CID 145135290) has the molecular formula C4H14N2O2S and a molecular weight of 154.24 g/mol. Its IUPAC name is 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine.

Molecular Properties

Compound Name2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine
PubChem CID145135290
Molecular FormulaC4H14N2O2S
Molecular Weight154.24 g/mol
Exact Mass154.08
IUPAC Name2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine
SMILESCN(C)S(O)(O)CCN
InChIInChI=1S/C4H14N2O2S/c1-6(2)9(7,8)4-3-5/h7-8H,3-5H2,1-2H3
InChIKeyHSRLDWNLOIWNGL-UHFFFAOYSA-N
XLogP0.17
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[ethyl(dihydroxy)-lambda4-sulfanyl]ethanamine
CID 142211074
Ethane;2-(trihydroxy-lambda4-sulfanyl)ethanamine
CID 142218623
N'-[dihydroxy(methyl)-lambda4-sulfanyl]-N'-methylethane-1,2-diamine
CID 142334211
2-[Amino(dihydroxy)-lambda4-sulfanyl]ethanamine
CID 142366006
2-[amino(dihydroxy)-lambda4-sulfanyl]-N-methylethanamine
CID 142366014
2-[amino(dihydroxy)-lambda4-sulfanyl]-N,N-dimethylethanamine
CID 142529539
4-[Amino(dihydroxy)-lambda4-sulfanyl]butan-2-amine
CID 142529596
2-[amino(dihydroxy)-lambda4-sulfanyl]-N-ethylethanamine
CID 142529660
2-[dihydroxy(methyl)-lambda4-sulfanyl]-N-methylethanamine
CID 143254270
2-[Dihydroxy(methylamino)-lambda4-sulfanyl]ethanamine;ethane
CID 144965893
2-[Dihydroxy(methylamino)-lambda4-sulfanyl]ethanamine
CID 144965894
2-[dihydroxy(methylamino)-lambda4-sulfanyl]-N,N-dimethylethanamine;ethane
CID 144965918

Frequently Asked Questions

What is the IUPAC name of 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine?
The IUPAC name of 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine (CID 145135290) is 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine.
What is the SMILES notation for 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine?
The canonical SMILES for 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine is CN(C)S(O)(O)CCN.
What is the InChIKey of 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine?
The InChIKey is HSRLDWNLOIWNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H14N2O2S/c1-6(2)9(7,8)4-3-5/h7-8H,3-5H2,1-2H3.
What are the key properties of 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine?
2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine has a molecular weight of 154.24 g/mol, XLogP of 0.17, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethylamino(dihydroxy)-λ4-sulfanyl]ethanamine is sourced from PubChem (CID 145135290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).