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

C12H22N2O — CID 14697357

IUPACN-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C12H22N2O/c1-6-10(15)13-9-7-11(2,3)14-12(4,5)8-9/h6,9,14H,1,7-8H2,2-5H3,(H,13,15)
InChIKeyREKHXRWEQQXQLZ-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.60
Rot. Bonds2

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

N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (PubChem CID 14697357) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
PubChem CID14697357
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C12H22N2O/c1-6-10(15)13-9-7-11(2,3)14-12(4,5)8-9/h6,9,14H,1,7-8H2,2-5H3,(H,13,15)
InChIKeyREKHXRWEQQXQLZ-UHFFFAOYSA-N
XLogP1.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide (CID 14697357) is N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is C=CC(=O)NC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
The InChIKey is REKHXRWEQQXQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-6-10(15)13-9-7-11(2,3)14-12(4,5)8-9/h6,9,14H,1,7-8H2,2-5H3,(H,13,15).
What are the key properties of N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide?
N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide has a molecular weight of 210.32 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,6,6-tetramethylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 14697357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).