2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide

C21H20N4O2S — CID 51211808

IUPAC2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide
SMILESO=C(Cc1csc(N2CCCC2=O)n1)NC(c1ccccc1)c1ccccn1
InChIInChI=1S/C21H20N4O2S/c26-18(13-16-14-28-21(23-16)25-12-6-10-19(25)27)24-20(15-7-2-1-3-8-15)17-9-4-5-11-22-17/h1-5,7-9,11,14,20H,6,10,12-13H2,(H,24,26)
InChIKeyRNNKGOWTKBCOQA-UHFFFAOYSA-N
MW392.48 g/mol
LogP3.11
Rot. Bonds6

About 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide

2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide (PubChem CID 51211808) has the molecular formula C21H20N4O2S and a molecular weight of 392.48 g/mol. Its IUPAC name is 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide
PubChem CID51211808
Molecular FormulaC21H20N4O2S
Molecular Weight392.48 g/mol
Exact Mass392.13
IUPAC Name2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide
SMILESO=C(Cc1csc(N2CCCC2=O)n1)NC(c1ccccc1)c1ccccn1
InChIInChI=1S/C21H20N4O2S/c26-18(13-16-14-28-21(23-16)25-12-6-10-19(25)27)24-20(15-7-2-1-3-8-15)17-9-4-5-11-22-17/h1-5,7-9,11,14,20H,6,10,12-13H2,(H,24,26)
InChIKeyRNNKGOWTKBCOQA-UHFFFAOYSA-N
XLogP3.11
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide 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

N-[1-(3-acetamidophenyl)ethyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 55585745
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
CID 55810226
N-[1-(3-chlorophenyl)propyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 55582083
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(2-phenylsulfanylphenyl)acetamide
CID 38169001
N-[(2S)-1-methoxypropan-2-yl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 29354926
1-[4-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]pyrrolidin-2-one
CID 39967713
N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 35066620
N-(1-amino-4-methylpentan-2-yl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 119586884
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 18200304
N-(2-methoxyphenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 27824972
N-(2,2-dimethylpropyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 75416990
(2-anilino-2-oxoethyl) 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetate
CID 8667672

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide?
The IUPAC name of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide (CID 51211808) is 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide.
What is the SMILES notation for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide?
The canonical SMILES for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide is O=C(Cc1csc(N2CCCC2=O)n1)NC(c1ccccc1)c1ccccn1.
What is the InChIKey of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide?
The InChIKey is RNNKGOWTKBCOQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2S/c26-18(13-16-14-28-21(23-16)25-12-6-10-19(25)27)24-20(15-7-2-1-3-8-15)17-9-4-5-11-22-17/h1-5,7-9,11,14,20H,6,10,12-13H2,(H,24,26).
What are the key properties of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide?
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide has a molecular weight of 392.48 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide is sourced from PubChem (CID 51211808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).