3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one

C5H10N2O2S — CID 167261225

IUPAC3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one
SMILESNCCN1C(=O)CSC1O
InChIInChI=1S/C5H10N2O2S/c6-1-2-7-4(8)3-10-5(7)9/h5,9H,1-3,6H2
InChIKeyIWRYMORSSMUIAT-UHFFFAOYSA-N
MW162.21 g/mol
LogP-1.20
Rot. Bonds2

About 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one

3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one (PubChem CID 167261225) has the molecular formula C5H10N2O2S and a molecular weight of 162.21 g/mol. Its IUPAC name is 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one
PubChem CID167261225
Molecular FormulaC5H10N2O2S
Molecular Weight162.21 g/mol
Exact Mass162.05
IUPAC Name3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one
SMILESNCCN1C(=O)CSC1O
InChIInChI=1S/C5H10N2O2S/c6-1-2-7-4(8)3-10-5(7)9/h5,9H,1-3,6H2
InChIKeyIWRYMORSSMUIAT-UHFFFAOYSA-N
XLogP-1.20
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.21
LogP ≤ 5-1.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one?
The IUPAC name of 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one (CID 167261225) is 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one is NCCN1C(=O)CSC1O.
What is the InChIKey of 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one?
The InChIKey is IWRYMORSSMUIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2S/c6-1-2-7-4(8)3-10-5(7)9/h5,9H,1-3,6H2.
What are the key properties of 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one?
3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one has a molecular weight of 162.21 g/mol, XLogP of -1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one is sourced from PubChem (CID 167261225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).