1-(1,3-thiazol-2-yl)pyrrolidin-2-one

C7H8N2OS — CID 574609

IUPAC1-(1,3-thiazol-2-yl)pyrrolidin-2-one
SMILESO=C1CCCN1c1nccs1
InChIInChI=1S/C7H8N2OS/c10-6-2-1-4-9(6)7-8-3-5-11-7/h3,5H,1-2,4H2
InChIKeyNSPIBVRMSCXUFE-UHFFFAOYSA-N
MW168.22 g/mol
LogP1.27
Rot. Bonds1

About 1-(1,3-thiazol-2-yl)pyrrolidin-2-one

1-(1,3-thiazol-2-yl)pyrrolidin-2-one (PubChem CID 574609) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is 1-(1,3-thiazol-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1,3-thiazol-2-yl)pyrrolidin-2-one
PubChem CID574609
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC Name1-(1,3-thiazol-2-yl)pyrrolidin-2-one
SMILESO=C1CCCN1c1nccs1
InChIInChI=1S/C7H8N2OS/c10-6-2-1-4-9(6)7-8-3-5-11-7/h3,5H,1-2,4H2
InChIKeyNSPIBVRMSCXUFE-UHFFFAOYSA-N
XLogP1.27
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(1,3-thiazol-2-yl)pyrrolidin-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

Related Compounds

1-[3-(2-Oxopyrrolidin-1-yl)propyl]-3-thiazol-2-yl-thiourea
CID 3003037
2-Imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
CID 607976
Propanamide, 3-(1-pyrrolidinyl)-N-(2-thiazolyl)-
CID 558586
2-(Pyrrolidin-1-yl)thiazole
CID 2513533
(2E)-3-prop-2-enyl-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-4-one
CID 5504709
1-(1,3-Thiazol-2-yl)pyrrolidine-2,5-dione
CID 934529
2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 3298328
N1-(3-(2-oxopyrrolidin-1-yl)propyl)-N2-(thiazol-2-yl)oxalamide
CID 18588848
(3R)-5-oxo-1-(1,3-thiazol-2-yl)pyrrolidine-3-carboxylic acid
CID 26967300
3-(1,3-Thiazol-2-yl)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one
CID 56818933
3-Ethyl-2-(1,3-thiazol-2-ylimino)-1,3-thiazolidin-4-one
CID 5667589
1-(5-Bromo-1,3-thiazol-2-yl)pyrrolidine-2,5-dione
CID 50987374

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-2-yl)pyrrolidin-2-one?
The IUPAC name of 1-(1,3-thiazol-2-yl)pyrrolidin-2-one (CID 574609) is 1-(1,3-thiazol-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1,3-thiazol-2-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(1,3-thiazol-2-yl)pyrrolidin-2-one is O=C1CCCN1c1nccs1.
What is the InChIKey of 1-(1,3-thiazol-2-yl)pyrrolidin-2-one?
The InChIKey is NSPIBVRMSCXUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c10-6-2-1-4-9(6)7-8-3-5-11-7/h3,5H,1-2,4H2.
What are the key properties of 1-(1,3-thiazol-2-yl)pyrrolidin-2-one?
1-(1,3-thiazol-2-yl)pyrrolidin-2-one has a molecular weight of 168.22 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazol-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 574609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).