N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide

C18H23N3OS — CID 95975344

IUPACN-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
SMILESC[C@@H]1CCC[C@H](c2ccccc2)N1CC(=O)N(C)c1nccs1
InChIInChI=1S/C18H23N3OS/c1-14-7-6-10-16(15-8-4-3-5-9-15)21(14)13-17(22)20(2)18-19-11-12-23-18/h3-5,8-9,11-12,14,16H,6-7,10,13H2,1-2H3/t14-,16-/m1/s1
InChIKeyJREMNLMGAKXXKW-GDBMZVCRSA-N
MW329.47 g/mol
LogP3.72
Rot. Bonds4

About N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide

N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 95975344) has the molecular formula C18H23N3OS and a molecular weight of 329.47 g/mol. Its IUPAC name is N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
PubChem CID95975344
Molecular FormulaC18H23N3OS
Molecular Weight329.47 g/mol
Exact Mass329.16
IUPAC NameN-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
SMILESC[C@@H]1CCC[C@H](c2ccccc2)N1CC(=O)N(C)c1nccs1
InChIInChI=1S/C18H23N3OS/c1-14-7-6-10-16(15-8-4-3-5-9-15)21(14)13-17(22)20(2)18-19-11-12-23-18/h3-5,8-9,11-12,14,16H,6-7,10,13H2,1-2H3/t14-,16-/m1/s1
InChIKeyJREMNLMGAKXXKW-GDBMZVCRSA-N
XLogP3.72
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(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 N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide (CID 95975344) is N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide is C[C@@H]1CCC[C@H](c2ccccc2)N1CC(=O)N(C)c1nccs1.
What is the InChIKey of N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is JREMNLMGAKXXKW-GDBMZVCRSA-N. The full InChI is InChI=1S/C18H23N3OS/c1-14-7-6-10-16(15-8-4-3-5-9-15)21(14)13-17(22)20(2)18-19-11-12-23-18/h3-5,8-9,11-12,14,16H,6-7,10,13H2,1-2H3/t14-,16-/m1/s1.
What are the key properties of N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide?
N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 329.47 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2R,6R)-2-methyl-6-phenylpiperidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 95975344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).