1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine

C20H38N2 — CID 152743668

IUPAC1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine
SMILESCN1C(C)(C)CC(=C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C20H38N2/c1-17(2)11-15(12-18(3,4)21(17)9)16-13-19(5,6)22(10)20(7,8)14-16/h11-14H2,1-10H3
InChIKeyLEGGCQJIOQUEEU-UHFFFAOYSA-N
MW306.54 g/mol
LogP4.85
Rot. Bonds

About 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine

1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine (PubChem CID 152743668) has the molecular formula C20H38N2 and a molecular weight of 306.54 g/mol. Its IUPAC name is 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine.

Molecular Properties

Compound Name1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine
PubChem CID152743668
Molecular FormulaC20H38N2
Molecular Weight306.54 g/mol
Exact Mass306.30
IUPAC Name1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine
SMILESCN1C(C)(C)CC(=C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C20H38N2/c1-17(2)11-15(12-18(3,4)21(17)9)16-13-19(5,6)22(10)20(7,8)14-16/h11-14H2,1-10H3
InChIKeyLEGGCQJIOQUEEU-UHFFFAOYSA-N
XLogP4.85
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.54
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine?
The IUPAC name of 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine (CID 152743668) is 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine.
What is the SMILES notation for 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine?
The canonical SMILES for 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine is CN1C(C)(C)CC(=C2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C.
What is the InChIKey of 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine?
The InChIKey is LEGGCQJIOQUEEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N2/c1-17(2)11-15(12-18(3,4)21(17)9)16-13-19(5,6)22(10)20(7,8)14-16/h11-14H2,1-10H3.
What are the key properties of 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine?
1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine has a molecular weight of 306.54 g/mol, XLogP of 4.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,6,6-pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-ylidene)piperidine is sourced from PubChem (CID 152743668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).