4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide

C15H23N3O3S — CID 30482916

IUPAC4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
SMILESCc1csc(=O)n1CCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C15H23N3O3S/c1-12-11-22-15(21)18(12)10-2-5-13(19)16-7-4-9-17-8-3-6-14(17)20/h11H,2-10H2,1H3,(H,16,19)
InChIKeyYLMSXIDSTLXCNF-UHFFFAOYSA-N
MW325.43 g/mol
LogP1.13
Rot. Bonds8

About 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide

4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide (PubChem CID 30482916) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide.

Molecular Properties

Compound Name4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
PubChem CID30482916
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
SMILESCc1csc(=O)n1CCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C15H23N3O3S/c1-12-11-22-15(21)18(12)10-2-5-13(19)16-7-4-9-17-8-3-6-14(17)20/h11H,2-10H2,1H3,(H,16,19)
InChIKeyYLMSXIDSTLXCNF-UHFFFAOYSA-N
XLogP1.13
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide 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 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The IUPAC name of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide (CID 30482916) is 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide.
What is the SMILES notation for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The canonical SMILES for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide is Cc1csc(=O)n1CCCC(=O)NCCCN1CCCC1=O.
What is the InChIKey of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The InChIKey is YLMSXIDSTLXCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-12-11-22-15(21)18(12)10-2-5-13(19)16-7-4-9-17-8-3-6-14(17)20/h11H,2-10H2,1H3,(H,16,19).
What are the key properties of 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide has a molecular weight of 325.43 g/mol, XLogP of 1.13, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide is sourced from PubChem (CID 30482916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).