2-pyrrolidin-3-yl-1,3-thiazolidine

C7H14N2S — CID 173372386

IUPAC2-pyrrolidin-3-yl-1,3-thiazolidine
SMILESC1CC(C2NCCS2)CN1
InChIInChI=1S/C7H14N2S/c1-2-8-5-6(1)7-9-3-4-10-7/h6-9H,1-5H2
InChIKeyOSBHKUPEJFEOBF-UHFFFAOYSA-N
MW158.27 g/mol
LogP0.26
Rot. Bonds1

About 2-pyrrolidin-3-yl-1,3-thiazolidine

2-pyrrolidin-3-yl-1,3-thiazolidine (PubChem CID 173372386) has the molecular formula C7H14N2S and a molecular weight of 158.27 g/mol. Its IUPAC name is 2-pyrrolidin-3-yl-1,3-thiazolidine.

Molecular Properties

Compound Name2-pyrrolidin-3-yl-1,3-thiazolidine
PubChem CID173372386
Molecular FormulaC7H14N2S
Molecular Weight158.27 g/mol
Exact Mass158.09
IUPAC Name2-pyrrolidin-3-yl-1,3-thiazolidine
SMILESC1CC(C2NCCS2)CN1
InChIInChI=1S/C7H14N2S/c1-2-8-5-6(1)7-9-3-4-10-7/h6-9H,1-5H2
InChIKeyOSBHKUPEJFEOBF-UHFFFAOYSA-N
XLogP0.26
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.27
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-yl-1,3-thiazolidine?
The IUPAC name of 2-pyrrolidin-3-yl-1,3-thiazolidine (CID 173372386) is 2-pyrrolidin-3-yl-1,3-thiazolidine.
What is the SMILES notation for 2-pyrrolidin-3-yl-1,3-thiazolidine?
The canonical SMILES for 2-pyrrolidin-3-yl-1,3-thiazolidine is C1CC(C2NCCS2)CN1.
What is the InChIKey of 2-pyrrolidin-3-yl-1,3-thiazolidine?
The InChIKey is OSBHKUPEJFEOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2S/c1-2-8-5-6(1)7-9-3-4-10-7/h6-9H,1-5H2.
What are the key properties of 2-pyrrolidin-3-yl-1,3-thiazolidine?
2-pyrrolidin-3-yl-1,3-thiazolidine has a molecular weight of 158.27 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-yl-1,3-thiazolidine is sourced from PubChem (CID 173372386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).