2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine

C6H15N3O2S — CID 83531067

IUPAC2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine
SMILESCCN1CCN(CCN)S1(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-2-8-5-6-9(4-3-7)12(8,10)11/h2-7H2,1H3
InChIKeyWZTYZNPRCNWLDT-UHFFFAOYSA-N
MW193.27 g/mol
LogP-1.17
Rot. Bonds3

About 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine

2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine (PubChem CID 83531067) has the molecular formula C6H15N3O2S and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine
PubChem CID83531067
Molecular FormulaC6H15N3O2S
Molecular Weight193.27 g/mol
Exact Mass193.09
IUPAC Name2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine
SMILESCCN1CCN(CCN)S1(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-2-8-5-6-9(4-3-7)12(8,10)11/h2-7H2,1H3
InChIKeyWZTYZNPRCNWLDT-UHFFFAOYSA-N
XLogP-1.17
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-1.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,5-Thiadiazolidine, 2-ethyl-, 1,1-dioxide
CID 10419354
2-Isopropyl-1,2,5-thiadiazolidine 1,1-dioxide
CID 10397135
2-(2-Aminoethyl)-1lambda6,2,5-thiadiazolidine-1,1-dione
CID 68282469
2-Methyl-1,2,5-thiadiazolidine 1,1-dioxide
CID 10393280
2-(Prop-2-yn-1-yl)-1lambda6,2,5-thiadiazolidine-1,1-dione
CID 97628793
2-[1,1-Dioxo-5-(2,2,2-trifluoroethyl)-1,2,5-thiadiazolidin-2-yl]ethanamine
CID 84803316
2-[1,1-dioxo-5-(2,2,2-trifluoroethyl)-1,2,5-thiadiazolidin-2-yl]-N-methylethanamine
CID 84806756
2-Butyl-1,2,5-thiadiazolidine 1,1-dioxide
CID 11412706
2-(tert-Butyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 12412514
2-Aminoethyl(ethyl)sulfamic acid
CID 18358423
2,4-Dimethyl-1,2,5-thiadiazolidine 1,1-dioxide
CID 19873535
N-ethylpyrrolidine-1-sulfonamide
CID 43243221

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine?
The IUPAC name of 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine (CID 83531067) is 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine.
What is the SMILES notation for 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine?
The canonical SMILES for 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine is CCN1CCN(CCN)S1(=O)=O.
What is the InChIKey of 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine?
The InChIKey is WZTYZNPRCNWLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2S/c1-2-8-5-6-9(4-3-7)12(8,10)11/h2-7H2,1H3.
What are the key properties of 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine?
2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine has a molecular weight of 193.27 g/mol, XLogP of -1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)ethanamine is sourced from PubChem (CID 83531067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).