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

C19H23N3O2S — CID 46469465

IUPACN-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCC(C)c1nc(CC(=O)Nc2cccc(CN3CCCC3=O)c2)cs1
InChIInChI=1S/C19H23N3O2S/c1-13(2)19-21-16(12-25-19)10-17(23)20-15-6-3-5-14(9-15)11-22-8-4-7-18(22)24/h3,5-6,9,12-13H,4,7-8,10-11H2,1-2H3,(H,20,23)
InChIKeyPZWSTLTUFMSNFI-UHFFFAOYSA-N
MW357.48 g/mol
LogP3.57
Rot. Bonds6

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

N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 46469465) has the molecular formula C19H23N3O2S and a molecular weight of 357.48 g/mol. Its IUPAC name is N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
PubChem CID46469465
Molecular FormulaC19H23N3O2S
Molecular Weight357.48 g/mol
Exact Mass357.15
IUPAC NameN-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCC(C)c1nc(CC(=O)Nc2cccc(CN3CCCC3=O)c2)cs1
InChIInChI=1S/C19H23N3O2S/c1-13(2)19-21-16(12-25-19)10-17(23)20-15-6-3-5-14(9-15)11-22-8-4-7-18(22)24/h3,5-6,9,12-13H,4,7-8,10-11H2,1-2H3,(H,20,23)
InChIKeyPZWSTLTUFMSNFI-UHFFFAOYSA-N
XLogP3.57
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

1-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-3-[(1R)-1-(1,3-thiazol-2-yl)ethyl]urea
CID 95314566
N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]hexanamide
CID 37359459
4-bromo-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56563195
1-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]urea
CID 86880052
N-(3-methylsulfonylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 9072651
2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]acetamide
CID 55911786
2-amino-2-methyl-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]propanamide;hydrochloride
CID 119309661
3-methyl-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]but-2-enamide
CID 30875155
N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-phenoxypropanamide
CID 46600220
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 38925497
3-(4-ethylphenyl)-N-[3-[(2-oxopiperidin-1-yl)methyl]phenyl]propanamide
CID 49360216
1-[(2R)-heptan-2-yl]-3-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]urea
CID 94784827

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide (CID 46469465) is N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide is CC(C)c1nc(CC(=O)Nc2cccc(CN3CCCC3=O)c2)cs1.
What is the InChIKey of N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is PZWSTLTUFMSNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S/c1-13(2)19-21-16(12-25-19)10-17(23)20-15-6-3-5-14(9-15)11-22-8-4-7-18(22)24/h3,5-6,9,12-13H,4,7-8,10-11H2,1-2H3,(H,20,23).
What are the key properties of N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 357.48 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 46469465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).