(4S)-4-thiophen-2-ylpyrrolidin-2-one

C8H9NOS — CID 51892814

IUPAC(4S)-4-thiophen-2-ylpyrrolidin-2-one
SMILESO=C1C[C@H](c2cccs2)CN1
InChIInChI=1S/C8H9NOS/c10-8-4-6(5-9-8)7-2-1-3-11-7/h1-3,6H,4-5H2,(H,9,10)/t6-/m0/s1
InChIKeyIUUVRTUBDHFZDR-LURJTMIESA-N
MW167.23 g/mol
LogP1.35
Rot. Bonds1

About (4S)-4-thiophen-2-ylpyrrolidin-2-one

(4S)-4-thiophen-2-ylpyrrolidin-2-one (PubChem CID 51892814) has the molecular formula C8H9NOS and a molecular weight of 167.23 g/mol. Its IUPAC name is (4S)-4-thiophen-2-ylpyrrolidin-2-one.

Molecular Properties

Compound Name(4S)-4-thiophen-2-ylpyrrolidin-2-one
PubChem CID51892814
Molecular FormulaC8H9NOS
Molecular Weight167.23 g/mol
Exact Mass167.04
IUPAC Name(4S)-4-thiophen-2-ylpyrrolidin-2-one
SMILESO=C1C[C@H](c2cccs2)CN1
InChIInChI=1S/C8H9NOS/c10-8-4-6(5-9-8)7-2-1-3-11-7/h1-3,6H,4-5H2,(H,9,10)/t6-/m0/s1
InChIKeyIUUVRTUBDHFZDR-LURJTMIESA-N
XLogP1.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4S)-4-thiophen-2-ylpyrrolidin-2-one 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 (4S)-4-thiophen-2-ylpyrrolidin-2-one?
The IUPAC name of (4S)-4-thiophen-2-ylpyrrolidin-2-one (CID 51892814) is (4S)-4-thiophen-2-ylpyrrolidin-2-one.
What is the SMILES notation for (4S)-4-thiophen-2-ylpyrrolidin-2-one?
The canonical SMILES for (4S)-4-thiophen-2-ylpyrrolidin-2-one is O=C1C[C@H](c2cccs2)CN1.
What is the InChIKey of (4S)-4-thiophen-2-ylpyrrolidin-2-one?
The InChIKey is IUUVRTUBDHFZDR-LURJTMIESA-N. The full InChI is InChI=1S/C8H9NOS/c10-8-4-6(5-9-8)7-2-1-3-11-7/h1-3,6H,4-5H2,(H,9,10)/t6-/m0/s1.
What are the key properties of (4S)-4-thiophen-2-ylpyrrolidin-2-one?
(4S)-4-thiophen-2-ylpyrrolidin-2-one has a molecular weight of 167.23 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-thiophen-2-ylpyrrolidin-2-one is sourced from PubChem (CID 51892814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).