N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide

C12H22N2O2 — CID 914735

IUPACN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C12H22N2O2/c1-6-10(15)13-9-7-11(2,3)14(16)12(4,5)8-9/h6,9,16H,1,7-8H2,2-5H3,(H,13,15)
InChIKeyKFPKGGLOJPMJPK-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.70
Rot. Bonds2

About N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide

N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (PubChem CID 914735) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
PubChem CID914735
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C12H22N2O2/c1-6-10(15)13-9-7-11(2,3)14(16)12(4,5)8-9/h6,9,16H,1,7-8H2,2-5H3,(H,13,15)
InChIKeyKFPKGGLOJPMJPK-UHFFFAOYSA-N
XLogP1.70
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-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-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (CID 914735) is N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is C=CC(=O)NC1CC(C)(C)N(O)C(C)(C)C1.
What is the InChIKey of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The InChIKey is KFPKGGLOJPMJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-6-10(15)13-9-7-11(2,3)14(16)12(4,5)8-9/h6,9,16H,1,7-8H2,2-5H3,(H,13,15).
What are the key properties of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide has a molecular weight of 226.32 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 914735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).