2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide

C14H21N3O3 — CID 47228360

IUPAC2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide
SMILESCc1noc(C)c1CC(=O)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C14H21N3O3/c1-9-12(10(2)20-16-9)8-14(19)17-5-3-11(4-6-17)7-13(15)18/h11H,3-8H2,1-2H3,(H2,15,18)
InChIKeyOHUTYIXHMZIWDL-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.95
Rot. Bonds4

About 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide

2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide (PubChem CID 47228360) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide
PubChem CID47228360
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide
SMILESCc1noc(C)c1CC(=O)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C14H21N3O3/c1-9-12(10(2)20-16-9)8-14(19)17-5-3-11(4-6-17)7-13(15)18/h11H,3-8H2,1-2H3,(H2,15,18)
InChIKeyOHUTYIXHMZIWDL-UHFFFAOYSA-N
XLogP0.95
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide (CID 47228360) is 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide is Cc1noc(C)c1CC(=O)N1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide?
The InChIKey is OHUTYIXHMZIWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-9-12(10(2)20-16-9)8-14(19)17-5-3-11(4-6-17)7-13(15)18/h11H,3-8H2,1-2H3,(H2,15,18).
What are the key properties of 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide?
2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide has a molecular weight of 279.34 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 47228360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).