1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

C16H19N3OS — CID 46907733

IUPAC1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESCc1ccc(-c2cnc(N3CCC(C(N)=O)CC3)s2)cc1
InChIInChI=1S/C16H19N3OS/c1-11-2-4-12(5-3-11)14-10-18-16(21-14)19-8-6-13(7-9-19)15(17)20/h2-5,10,13H,6-9H2,1H3,(H2,17,20)
InChIKeySSSZAQRWKDVVDT-UHFFFAOYSA-N
MW301.42 g/mol
LogP2.82
Rot. Bonds3

About 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide

1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (PubChem CID 46907733) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
PubChem CID46907733
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
SMILESCc1ccc(-c2cnc(N3CCC(C(N)=O)CC3)s2)cc1
InChIInChI=1S/C16H19N3OS/c1-11-2-4-12(5-3-11)14-10-18-16(21-14)19-8-6-13(7-9-19)15(17)20/h2-5,10,13H,6-9H2,1H3,(H2,17,20)
InChIKeySSSZAQRWKDVVDT-UHFFFAOYSA-N
XLogP2.82
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[5-[4-(Methylthio)phenyl]-2-thiazolyl]-4-piperidinecarboxamide
CID 46907676
1-Methyl-N-(5-phenylthiazol-2-yl)piperidine-4-carboxamide
CID 131953480
N-(5-((4-phenylpiperidin-1-yl)methyl)thiazol-2-yl)acetamide
CID 778225
N-(5-methyl-1,3-thiazol-2-yl)-3-phenylpropanamide
CID 2083675
2-(3,4-dimethylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2673045
N-(5-cyclobutylthiazol-2-yl)-2-phenylacetamide
CID 9921612
2-phenyl-N-(5-propan-2-yl-2-thiazolyl)acetamide
CID 16760027
N-(5-Ethylthiazol-2-yl)-2-phenylacetamide
CID 44396065
4-[[ethyl-[5-(4-methylphenyl)-1,3-thiazol-2-yl]amino]methyl]-N-hydroxybenzamide
CID 45102714
N-hydroxy-4-[[[5-(4-methylphenyl)-1,3-thiazol-2-yl]-propylamino]methyl]benzamide
CID 45102715
N-hydroxy-4-[[[5-(4-methylphenyl)-1,3-thiazol-2-yl]-(2-methylpropyl)amino]methyl]benzamide
CID 45487906
1-[5-(4-Bromophenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 46907662

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide (CID 46907733) is 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is Cc1ccc(-c2cnc(N3CCC(C(N)=O)CC3)s2)cc1.
What is the InChIKey of 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
The InChIKey is SSSZAQRWKDVVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-11-2-4-12(5-3-11)14-10-18-16(21-14)19-8-6-13(7-9-19)15(17)20/h2-5,10,13H,6-9H2,1H3,(H2,17,20).
What are the key properties of 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide?
1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide has a molecular weight of 301.42 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 46907733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).