2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide

C17H18ClN3O2S — CID 46113974

IUPAC2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nc(C(=O)N2CCCCC2)cs1
InChIInChI=1S/C17H18ClN3O2S/c18-13-6-4-12(5-7-13)10-15(22)20-17-19-14(11-24-17)16(23)21-8-2-1-3-9-21/h4-7,11H,1-3,8-10H2,(H,19,20,22)
InChIKeyJGOYEQJIKOYXKU-UHFFFAOYSA-N
MW363.87 g/mol
LogP3.60
Rot. Bonds4

About 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide

2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 46113974) has the molecular formula C17H18ClN3O2S and a molecular weight of 363.87 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide
PubChem CID46113974
Molecular FormulaC17H18ClN3O2S
Molecular Weight363.87 g/mol
Exact Mass363.08
IUPAC Name2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nc(C(=O)N2CCCCC2)cs1
InChIInChI=1S/C17H18ClN3O2S/c18-13-6-4-12(5-7-13)10-15(22)20-17-19-14(11-24-17)16(23)21-8-2-1-3-9-21/h4-7,11H,1-3,8-10H2,(H,19,20,22)
InChIKeyJGOYEQJIKOYXKU-UHFFFAOYSA-N
XLogP3.60
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.87
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-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

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide (CID 46113974) is 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide is O=C(Cc1ccc(Cl)cc1)Nc1nc(C(=O)N2CCCCC2)cs1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is JGOYEQJIKOYXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O2S/c18-13-6-4-12(5-7-13)10-15(22)20-17-19-14(11-24-17)16(23)21-8-2-1-3-9-21/h4-7,11H,1-3,8-10H2,(H,19,20,22).
What are the key properties of 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide?
2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 363.87 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 46113974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).