N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide

C15H24N2O2 — CID 66599463

IUPACN-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)N(C(=O)C=C)C(C)(C)C1
InChIInChI=1S/C15H24N2O2/c1-7-12(18)16-11-9-14(3,4)17(13(19)8-2)15(5,6)10-11/h7-8,11H,1-2,9-10H2,3-6H3,(H,16,18)
InChIKeyLXYCPIJMFWWPNN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.02
Rot. Bonds3

About N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide

N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide (PubChem CID 66599463) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide
PubChem CID66599463
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide
SMILESC=CC(=O)NC1CC(C)(C)N(C(=O)C=C)C(C)(C)C1
InChIInChI=1S/C15H24N2O2/c1-7-12(18)16-11-9-14(3,4)17(13(19)8-2)15(5,6)10-11/h7-8,11H,1-2,9-10H2,3-6H3,(H,16,18)
InChIKeyLXYCPIJMFWWPNN-UHFFFAOYSA-N
XLogP2.02
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
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-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide (CID 66599463) is N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide is C=CC(=O)NC1CC(C)(C)N(C(=O)C=C)C(C)(C)C1.
What is the InChIKey of N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide?
The InChIKey is LXYCPIJMFWWPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-7-12(18)16-11-9-14(3,4)17(13(19)8-2)15(5,6)10-11/h7-8,11H,1-2,9-10H2,3-6H3,(H,16,18).
What are the key properties of N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide?
N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide has a molecular weight of 264.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 66599463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).