N-piperidin-4-yloxybut-2-enamide

C9H16N2O2 — CID 175709577

IUPACN-piperidin-4-yloxybut-2-enamide
SMILESCC=CC(=O)NOC1CCNCC1
InChIInChI=1S/C9H16N2O2/c1-2-3-9(12)11-13-8-4-6-10-7-5-8/h2-3,8,10H,4-7H2,1H3,(H,11,12)
InChIKeyJIUDXEKLLOSJDL-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.36
Rot. Bonds3

About N-piperidin-4-yloxybut-2-enamide

N-piperidin-4-yloxybut-2-enamide (PubChem CID 175709577) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-piperidin-4-yloxybut-2-enamide.

Molecular Properties

Compound NameN-piperidin-4-yloxybut-2-enamide
PubChem CID175709577
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-piperidin-4-yloxybut-2-enamide
SMILESCC=CC(=O)NOC1CCNCC1
InChIInChI=1S/C9H16N2O2/c1-2-3-9(12)11-13-8-4-6-10-7-5-8/h2-3,8,10H,4-7H2,1H3,(H,11,12)
InChIKeyJIUDXEKLLOSJDL-UHFFFAOYSA-N
XLogP0.36
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-piperidin-4-yloxybut-2-enamide 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-piperidin-4-yloxybut-2-enamide?
The IUPAC name of N-piperidin-4-yloxybut-2-enamide (CID 175709577) is N-piperidin-4-yloxybut-2-enamide.
What is the SMILES notation for N-piperidin-4-yloxybut-2-enamide?
The canonical SMILES for N-piperidin-4-yloxybut-2-enamide is CC=CC(=O)NOC1CCNCC1.
What is the InChIKey of N-piperidin-4-yloxybut-2-enamide?
The InChIKey is JIUDXEKLLOSJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-3-9(12)11-13-8-4-6-10-7-5-8/h2-3,8,10H,4-7H2,1H3,(H,11,12).
What are the key properties of N-piperidin-4-yloxybut-2-enamide?
N-piperidin-4-yloxybut-2-enamide has a molecular weight of 184.24 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yloxybut-2-enamide is sourced from PubChem (CID 175709577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).