2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide

C19H36N2O — CID 68997062

IUPAC2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide
SMILESC=C(C)C(=O)NC1CC(CC)(CC)N(CC)C(CC)(CC)C1
InChIInChI=1S/C19H36N2O/c1-8-18(9-2)13-16(20-17(22)15(6)7)14-19(10-3,11-4)21(18)12-5/h16H,6,8-14H2,1-5,7H3,(H,20,22)
InChIKeyOYLQHBIEXIAVBR-UHFFFAOYSA-N
MW308.51 g/mol
LogP4.28
Rot. Bonds7

About 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide

2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide (PubChem CID 68997062) has the molecular formula C19H36N2O and a molecular weight of 308.51 g/mol. Its IUPAC name is 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide.

Molecular Properties

Compound Name2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide
PubChem CID68997062
Molecular FormulaC19H36N2O
Molecular Weight308.51 g/mol
Exact Mass308.28
IUPAC Name2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide
SMILESC=C(C)C(=O)NC1CC(CC)(CC)N(CC)C(CC)(CC)C1
InChIInChI=1S/C19H36N2O/c1-8-18(9-2)13-16(20-17(22)15(6)7)14-19(10-3,11-4)21(18)12-5/h16H,6,8-14H2,1-5,7H3,(H,20,22)
InChIKeyOYLQHBIEXIAVBR-UHFFFAOYSA-N
XLogP4.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.51
LogP ≤ 54.28
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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Related Compounds

N-(2,2,6,6-Tetramethylpiperidin-4-yl)methacrylamide
CID 17995532
n-(2,2,6,6-Tetramethylpiperidin-4-yl)acrylamide
CID 14697357
N-(2,2,6,6-tetramethyl-1-prop-2-enoylpiperidin-4-yl)prop-2-enamide
CID 66599463
CID 101232574
CID 101232574
N-(1,2,2,6,6-pentamethylpiperidin-4-yl)prop-2-enamide
CID 12991967
N-(2,6-diethyl-1,2,6-trimethylpiperidin-4-yl)prop-2-enamide
CID 12991971
2-methyl-N-(1,2,2,6,6-pentamethylpiperidin-3-yl)prop-2-enamide
CID 17814528
N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-2-methylprop-2-enamide
CID 17846581
2-methyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)prop-2-enamide chloride
CID 17995535
Trimethyl-[6-methyl-6-(2-methylprop-2-enoylamino)octan-3-yl]azanium chloride
CID 18366335
Trimethyl-[6-methyl-6-(2-methylprop-2-enoylamino)octan-3-yl]azanium
CID 18366336
(E)-N-[1-[(E)-but-2-enoyl]-2,2,6,6-tetramethylpiperidin-4-yl]but-2-enamide
CID 18521165

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide?
The IUPAC name of 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide (CID 68997062) is 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide.
What is the SMILES notation for 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide?
The canonical SMILES for 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide is C=C(C)C(=O)NC1CC(CC)(CC)N(CC)C(CC)(CC)C1.
What is the InChIKey of 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide?
The InChIKey is OYLQHBIEXIAVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N2O/c1-8-18(9-2)13-16(20-17(22)15(6)7)14-19(10-3,11-4)21(18)12-5/h16H,6,8-14H2,1-5,7H3,(H,20,22).
What are the key properties of 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide?
2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide has a molecular weight of 308.51 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,2,2,6,6-pentaethylpiperidin-4-yl)prop-2-enamide is sourced from PubChem (CID 68997062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).