2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide

C12H22N2O — CID 22755849

IUPAC2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide
SMILESCN1C(C)(C)CC(=CC(N)=O)CC1(C)C
InChIInChI=1S/C12H22N2O/c1-11(2)7-9(6-10(13)15)8-12(3,4)14(11)5/h6H,7-8H2,1-5H3,(H2,13,15)
InChIKeyZNQRVTFIZFWCMY-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.68
Rot. Bonds1

About 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide

2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide (PubChem CID 22755849) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide.

Molecular Properties

Compound Name2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide
PubChem CID22755849
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide
SMILESCN1C(C)(C)CC(=CC(N)=O)CC1(C)C
InChIInChI=1S/C12H22N2O/c1-11(2)7-9(6-10(13)15)8-12(3,4)14(11)5/h6H,7-8H2,1-5H3,(H2,13,15)
InChIKeyZNQRVTFIZFWCMY-UHFFFAOYSA-N
XLogP1.68
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.68
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 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide?
The IUPAC name of 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide (CID 22755849) is 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide.
What is the SMILES notation for 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide?
The canonical SMILES for 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide is CN1C(C)(C)CC(=CC(N)=O)CC1(C)C.
What is the InChIKey of 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide?
The InChIKey is ZNQRVTFIZFWCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-11(2)7-9(6-10(13)15)8-12(3,4)14(11)5/h6H,7-8H2,1-5H3,(H2,13,15).
What are the key properties of 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide?
2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide has a molecular weight of 210.32 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)acetamide is sourced from PubChem (CID 22755849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).