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

C15H25N3O2S — CID 86866495

IUPAC2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide
SMILESCc1csc(=O)n1CC(=O)NCC1CCCN(C(C)C)C1
InChIInChI=1S/C15H25N3O2S/c1-11(2)17-6-4-5-13(8-17)7-16-14(19)9-18-12(3)10-21-15(18)20/h10-11,13H,4-9H2,1-3H3,(H,16,19)
InChIKeyCKBBKBVFTURDGD-UHFFFAOYSA-N
MW311.45 g/mol
LogP1.45
Rot. Bonds5

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

2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide (PubChem CID 86866495) has the molecular formula C15H25N3O2S and a molecular weight of 311.45 g/mol. Its IUPAC name is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide
PubChem CID86866495
Molecular FormulaC15H25N3O2S
Molecular Weight311.45 g/mol
Exact Mass311.17
IUPAC Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide
SMILESCc1csc(=O)n1CC(=O)NCC1CCCN(C(C)C)C1
InChIInChI=1S/C15H25N3O2S/c1-11(2)17-6-4-5-13(8-17)7-16-14(19)9-18-12(3)10-21-15(18)20/h10-11,13H,4-9H2,1-3H3,(H,16,19)
InChIKeyCKBBKBVFTURDGD-UHFFFAOYSA-N
XLogP1.45
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-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

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide?
The IUPAC name of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide (CID 86866495) is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide?
The canonical SMILES for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide is Cc1csc(=O)n1CC(=O)NCC1CCCN(C(C)C)C1.
What is the InChIKey of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide?
The InChIKey is CKBBKBVFTURDGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2S/c1-11(2)17-6-4-5-13(8-17)7-16-14(19)9-18-12(3)10-21-15(18)20/h10-11,13H,4-9H2,1-3H3,(H,16,19).
What are the key properties of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide?
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide has a molecular weight of 311.45 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-propan-2-ylpiperidin-3-yl)methyl]acetamide is sourced from PubChem (CID 86866495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).