2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide

C16H19N3OS — CID 3767568

IUPAC2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Nc1nccs1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C16H19N3OS/c20-15(18-16-17-9-12-21-16)14(13-7-3-1-4-8-13)19-10-5-2-6-11-19/h1,3-4,7-9,12,14H,2,5-6,10-11H2,(H,17,18,20)
InChIKeyYHAPKGVGAGARFK-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.31
Rot. Bonds4

About 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide

2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 3767568) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide
PubChem CID3767568
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(Nc1nccs1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C16H19N3OS/c20-15(18-16-17-9-12-21-16)14(13-7-3-1-4-8-13)19-10-5-2-6-11-19/h1,3-4,7-9,12,14H,2,5-6,10-11H2,(H,17,18,20)
InChIKeyYHAPKGVGAGARFK-UHFFFAOYSA-N
XLogP3.31
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide (CID 3767568) is 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide is O=C(Nc1nccs1)C(c1ccccc1)N1CCCCC1.
What is the InChIKey of 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is YHAPKGVGAGARFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c20-15(18-16-17-9-12-21-16)14(13-7-3-1-4-8-13)19-10-5-2-6-11-19/h1,3-4,7-9,12,14H,2,5-6,10-11H2,(H,17,18,20).
What are the key properties of 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide?
2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 301.42 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-piperidin-1-yl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 3767568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).