2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine

C7H17N3O4S2 — CID 48946734

IUPAC2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine
SMILESCN(C)S(=O)(=O)NCCN1CCCS1(=O)=O
InChIInChI=1S/C7H17N3O4S2/c1-9(2)16(13,14)8-4-6-10-5-3-7-15(10,11)12/h8H,3-7H2,1-2H3
InChIKeyKTIPMIDIOFDLGS-UHFFFAOYSA-N
MW271.36 g/mol
LogP-1.58
Rot. Bonds5

About 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine

2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine (PubChem CID 48946734) has the molecular formula C7H17N3O4S2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine.

Molecular Properties

Compound Name2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine
PubChem CID48946734
Molecular FormulaC7H17N3O4S2
Molecular Weight271.36 g/mol
Exact Mass271.07
IUPAC Name2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine
SMILESCN(C)S(=O)(=O)NCCN1CCCS1(=O)=O
InChIInChI=1S/C7H17N3O4S2/c1-9(2)16(13,14)8-4-6-10-5-3-7-15(10,11)12/h8H,3-7H2,1-2H3
InChIKeyKTIPMIDIOFDLGS-UHFFFAOYSA-N
XLogP-1.58
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-1.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine?
The IUPAC name of 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine (CID 48946734) is 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine.
What is the SMILES notation for 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine?
The canonical SMILES for 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine is CN(C)S(=O)(=O)NCCN1CCCS1(=O)=O.
What is the InChIKey of 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine?
The InChIKey is KTIPMIDIOFDLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O4S2/c1-9(2)16(13,14)8-4-6-10-5-3-7-15(10,11)12/h8H,3-7H2,1-2H3.
What are the key properties of 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine?
2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine has a molecular weight of 271.36 g/mol, XLogP of -1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylsulfamoylamino)ethyl]-1,1-dioxo-1,2-thiazolidine is sourced from PubChem (CID 48946734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).