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

C18H29N3O2S — CID 17482860

IUPAC2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCc1csc(=O)n1CC(=O)NCC1(N2CCCCC2)CCCCC1
InChIInChI=1S/C18H29N3O2S/c1-15-13-24-17(23)21(15)12-16(22)19-14-18(8-4-2-5-9-18)20-10-6-3-7-11-20/h13H,2-12,14H2,1H3,(H,19,22)
InChIKeyKBQANCHRMKKPKC-UHFFFAOYSA-N
MW351.52 g/mol
LogP2.52
Rot. Bonds5

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

2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (PubChem CID 17482860) has the molecular formula C18H29N3O2S and a molecular weight of 351.52 g/mol. Its IUPAC name is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
PubChem CID17482860
Molecular FormulaC18H29N3O2S
Molecular Weight351.52 g/mol
Exact Mass351.20
IUPAC Name2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCc1csc(=O)n1CC(=O)NCC1(N2CCCCC2)CCCCC1
InChIInChI=1S/C18H29N3O2S/c1-15-13-24-17(23)21(15)12-16(22)19-14-18(8-4-2-5-9-18)20-10-6-3-7-11-20/h13H,2-12,14H2,1H3,(H,19,22)
InChIKeyKBQANCHRMKKPKC-UHFFFAOYSA-N
XLogP2.52
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.52
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)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-piperidin-1-ylcyclohexyl)methyl]acetamide?
The IUPAC name of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (CID 17482860) is 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide is Cc1csc(=O)n1CC(=O)NCC1(N2CCCCC2)CCCCC1.
What is the InChIKey of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The InChIKey is KBQANCHRMKKPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O2S/c1-15-13-24-17(23)21(15)12-16(22)19-14-18(8-4-2-5-9-18)20-10-6-3-7-11-20/h13H,2-12,14H2,1H3,(H,19,22).
What are the key properties of 2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide has a molecular weight of 351.52 g/mol, XLogP of 2.52, 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-piperidin-1-ylcyclohexyl)methyl]acetamide is sourced from PubChem (CID 17482860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).