2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide

C14H26N2O2 — CID 63844811

IUPAC2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide
SMILESCCC(C)NC(=O)C(C)N1CCCCC1C(C)=O
InChIInChI=1S/C14H26N2O2/c1-5-10(2)15-14(18)11(3)16-9-7-6-8-13(16)12(4)17/h10-11,13H,5-9H2,1-4H3,(H,15,18)
InChIKeyCMTULIFJRHINFQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.73
Rot. Bonds5

About 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide

2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide (PubChem CID 63844811) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide.

Molecular Properties

Compound Name2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide
PubChem CID63844811
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide
SMILESCCC(C)NC(=O)C(C)N1CCCCC1C(C)=O
InChIInChI=1S/C14H26N2O2/c1-5-10(2)15-14(18)11(3)16-9-7-6-8-13(16)12(4)17/h10-11,13H,5-9H2,1-4H3,(H,15,18)
InChIKeyCMTULIFJRHINFQ-UHFFFAOYSA-N
XLogP1.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide 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-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide?
The IUPAC name of 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide (CID 63844811) is 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide.
What is the SMILES notation for 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide?
The canonical SMILES for 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide is CCC(C)NC(=O)C(C)N1CCCCC1C(C)=O.
What is the InChIKey of 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide?
The InChIKey is CMTULIFJRHINFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-5-10(2)15-14(18)11(3)16-9-7-6-8-13(16)12(4)17/h10-11,13H,5-9H2,1-4H3,(H,15,18).
What are the key properties of 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide?
2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide has a molecular weight of 254.37 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylpiperidin-1-yl)-N-butan-2-ylpropanamide is sourced from PubChem (CID 63844811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).