2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide

C19H23N3O2S — CID 134702730

IUPAC2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCC(C)c1ccc(-c2csc(NC(=O)C(C)N3CCCC3=O)n2)cc1
InChIInChI=1S/C19H23N3O2S/c1-12(2)14-6-8-15(9-7-14)16-11-25-19(20-16)21-18(24)13(3)22-10-4-5-17(22)23/h6-9,11-13H,4-5,10H2,1-3H3,(H,20,21,24)
InChIKeyBJWXLYGAKHDCOI-UHFFFAOYSA-N
MW357.48 g/mol
LogP3.88
Rot. Bonds5

About 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide

2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide (PubChem CID 134702730) has the molecular formula C19H23N3O2S and a molecular weight of 357.48 g/mol. Its IUPAC name is 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound Name2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide
PubChem CID134702730
Molecular FormulaC19H23N3O2S
Molecular Weight357.48 g/mol
Exact Mass357.15
IUPAC Name2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCC(C)c1ccc(-c2csc(NC(=O)C(C)N3CCCC3=O)n2)cc1
InChIInChI=1S/C19H23N3O2S/c1-12(2)14-6-8-15(9-7-14)16-11-25-19(20-16)21-18(24)13(3)22-10-4-5-17(22)23/h6-9,11-13H,4-5,10H2,1-3H3,(H,20,21,24)
InChIKeyBJWXLYGAKHDCOI-UHFFFAOYSA-N
XLogP3.88
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-acetamido-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide
CID 75869192
2,3,4,5,6-pentafluoro-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]benzamide
CID 4060927
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-4-propan-2-ylbenzamide
CID 4120073
1-(cyclopropanecarbonyl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 25481173
(2S)-2-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide
CID 7024090
N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]butanamide
CID 3681052
N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
CID 896408
1-N,3-N-bis[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]benzene-1,3-dicarboxamide
CID 3495731
(1R,2R,3R,4S)-3-[[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid
CID 1223499
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[4-[2-oxo-2-(propan-2-ylamino)ethyl]piperazin-1-yl]propanamide
CID 78825134
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide
CID 43951183
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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide?
The IUPAC name of 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide (CID 134702730) is 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide is CC(C)c1ccc(-c2csc(NC(=O)C(C)N3CCCC3=O)n2)cc1.
What is the InChIKey of 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide?
The InChIKey is BJWXLYGAKHDCOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S/c1-12(2)14-6-8-15(9-7-14)16-11-25-19(20-16)21-18(24)13(3)22-10-4-5-17(22)23/h6-9,11-13H,4-5,10H2,1-3H3,(H,20,21,24).
What are the key properties of 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide?
2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide has a molecular weight of 357.48 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxopyrrolidin-1-yl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 134702730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).