2-(thiolan-2-yl)pyrrolidine

C8H15NS — CID 18510131

IUPAC2-(thiolan-2-yl)pyrrolidine
SMILESC1CNC(C2CCCS2)C1
InChIInChI=1S/C8H15NS/c1-3-7(9-5-1)8-4-2-6-10-8/h7-9H,1-6H2
InChIKeyWGKXMRSPFOEJIE-UHFFFAOYSA-N
MW157.28 g/mol
LogP1.63
Rot. Bonds1

About 2-(thiolan-2-yl)pyrrolidine

2-(thiolan-2-yl)pyrrolidine (PubChem CID 18510131) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is 2-(thiolan-2-yl)pyrrolidine.

Molecular Properties

Compound Name2-(thiolan-2-yl)pyrrolidine
PubChem CID18510131
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC Name2-(thiolan-2-yl)pyrrolidine
SMILESC1CNC(C2CCCS2)C1
InChIInChI=1S/C8H15NS/c1-3-7(9-5-1)8-4-2-6-10-8/h7-9H,1-6H2
InChIKeyWGKXMRSPFOEJIE-UHFFFAOYSA-N
XLogP1.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(thiolan-2-yl)pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(thiolan-2-yl)pyrrolidine?
The IUPAC name of 2-(thiolan-2-yl)pyrrolidine (CID 18510131) is 2-(thiolan-2-yl)pyrrolidine.
What is the SMILES notation for 2-(thiolan-2-yl)pyrrolidine?
The canonical SMILES for 2-(thiolan-2-yl)pyrrolidine is C1CNC(C2CCCS2)C1.
What is the InChIKey of 2-(thiolan-2-yl)pyrrolidine?
The InChIKey is WGKXMRSPFOEJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS/c1-3-7(9-5-1)8-4-2-6-10-8/h7-9H,1-6H2.
What are the key properties of 2-(thiolan-2-yl)pyrrolidine?
2-(thiolan-2-yl)pyrrolidine has a molecular weight of 157.28 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiolan-2-yl)pyrrolidine is sourced from PubChem (CID 18510131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).