2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride

C10H20ClN3O3S — CID 119550083

IUPAC2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
SMILESCN(C(=O)CN1CCCS1(=O)=O)C1CCNC1.Cl
InChIInChI=1S/C10H19N3O3S.ClH/c1-12(9-3-4-11-7-9)10(14)8-13-5-2-6-17(13,15)16;/h9,11H,2-8H2,1H3;1H
InChIKeyVAUJTBZQSMFSMY-UHFFFAOYSA-N
MW297.81 g/mol
LogP-0.74
Rot. Bonds3

About 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride

2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride (PubChem CID 119550083) has the molecular formula C10H20ClN3O3S and a molecular weight of 297.81 g/mol. Its IUPAC name is 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
PubChem CID119550083
Molecular FormulaC10H20ClN3O3S
Molecular Weight297.81 g/mol
Exact Mass297.09
IUPAC Name2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
SMILESCN(C(=O)CN1CCCS1(=O)=O)C1CCNC1.Cl
InChIInChI=1S/C10H19N3O3S.ClH/c1-12(9-3-4-11-7-9)10(14)8-13-5-2-6-17(13,15)16;/h9,11H,2-8H2,1H3;1H
InChIKeyVAUJTBZQSMFSMY-UHFFFAOYSA-N
XLogP-0.74
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.81
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride?
The IUPAC name of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride (CID 119550083) is 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride.
What is the SMILES notation for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride?
The canonical SMILES for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride is CN(C(=O)CN1CCCS1(=O)=O)C1CCNC1.Cl.
What is the InChIKey of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride?
The InChIKey is VAUJTBZQSMFSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3S.ClH/c1-12(9-3-4-11-7-9)10(14)8-13-5-2-6-17(13,15)16;/h9,11H,2-8H2,1H3;1H.
What are the key properties of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride?
2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride has a molecular weight of 297.81 g/mol, XLogP of -0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride is sourced from PubChem (CID 119550083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).