rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate

C4H6NO2RbS — CID 59200106

IUPACrubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate
SMILESO=C([O-])[C@@H]1NCCS1.[Rb+]
InChIInChI=1S/C4H7NO2S.Rb/c6-4(7)3-5-1-2-8-3;/h3,5H,1-2H2,(H,6,7);/q;+1/p-1/t3-;/m1./s1
InChIKeyRSVOGMZKTBOKHI-AENDTGMFSA-M
MW217.63 g/mol
LogP-4.60
Rot. Bonds1

About rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate

rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate (PubChem CID 59200106) has the molecular formula C4H6NO2RbS and a molecular weight of 217.63 g/mol. Its IUPAC name is rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate.

Molecular Properties

Compound Namerubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate
PubChem CID59200106
Molecular FormulaC4H6NO2RbS
Molecular Weight217.63 g/mol
Exact Mass216.92
IUPAC Namerubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate
SMILESO=C([O-])[C@@H]1NCCS1.[Rb+]
InChIInChI=1S/C4H7NO2S.Rb/c6-4(7)3-5-1-2-8-3;/h3,5H,1-2H2,(H,6,7);/q;+1/p-1/t3-;/m1./s1
InChIKeyRSVOGMZKTBOKHI-AENDTGMFSA-M
XLogP-4.60
TPSA52.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.63
LogP ≤ 5-4.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate?
The IUPAC name of rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate (CID 59200106) is rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate.
What is the SMILES notation for rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate?
The canonical SMILES for rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate is O=C([O-])[C@@H]1NCCS1.[Rb+].
What is the InChIKey of rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate?
The InChIKey is RSVOGMZKTBOKHI-AENDTGMFSA-M. The full InChI is InChI=1S/C4H7NO2S.Rb/c6-4(7)3-5-1-2-8-3;/h3,5H,1-2H2,(H,6,7);/q;+1/p-1/t3-;/m1./s1.
What are the key properties of rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate?
rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate has a molecular weight of 217.63 g/mol, XLogP of -4.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for rubidium(1+);(2R)-1,3-thiazolidine-2-carboxylate is sourced from PubChem (CID 59200106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).