N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide

C20H30N2O3 — CID 122388240

IUPACN-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide
SMILESCCNC(=O)C(ON1C(C)(C)CCCC1(C)C)C(=O)c1ccccc1
InChIInChI=1S/C20H30N2O3/c1-6-21-18(24)17(16(23)15-11-8-7-9-12-15)25-22-19(2,3)13-10-14-20(22,4)5/h7-9,11-12,17H,6,10,13-14H2,1-5H3,(H,21,24)
InChIKeyIAHNYXQIJWMUSH-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.35
Rot. Bonds6

About N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide

N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide (PubChem CID 122388240) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide.

Molecular Properties

Compound NameN-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide
PubChem CID122388240
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide
SMILESCCNC(=O)C(ON1C(C)(C)CCCC1(C)C)C(=O)c1ccccc1
InChIInChI=1S/C20H30N2O3/c1-6-21-18(24)17(16(23)15-11-8-7-9-12-15)25-22-19(2,3)13-10-14-20(22,4)5/h7-9,11-12,17H,6,10,13-14H2,1-5H3,(H,21,24)
InChIKeyIAHNYXQIJWMUSH-UHFFFAOYSA-N
XLogP3.35
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide?
The IUPAC name of N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide (CID 122388240) is N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide.
What is the SMILES notation for N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide?
The canonical SMILES for N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide is CCNC(=O)C(ON1C(C)(C)CCCC1(C)C)C(=O)c1ccccc1.
What is the InChIKey of N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide?
The InChIKey is IAHNYXQIJWMUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-6-21-18(24)17(16(23)15-11-8-7-9-12-15)25-22-19(2,3)13-10-14-20(22,4)5/h7-9,11-12,17H,6,10,13-14H2,1-5H3,(H,21,24).
What are the key properties of N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide?
N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide has a molecular weight of 346.47 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-oxo-3-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxypropanamide is sourced from PubChem (CID 122388240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).