1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine

C22H42N2 — CID 21401056

IUPAC1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine
SMILESCCN1C(C)(C)CC(=C2CC(C)(C)N(CC)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C22H42N2/c1-11-23-19(3,4)13-17(14-20(23,5)6)18-15-21(7,8)24(12-2)22(9,10)16-18/h11-16H2,1-10H3
InChIKeyZRTJNGYWBNZHAQ-UHFFFAOYSA-N
MW334.59 g/mol
LogP5.63
Rot. Bonds2

About 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine

1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine (PubChem CID 21401056) has the molecular formula C22H42N2 and a molecular weight of 334.59 g/mol. Its IUPAC name is 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine
PubChem CID21401056
Molecular FormulaC22H42N2
Molecular Weight334.59 g/mol
Exact Mass334.33
IUPAC Name1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine
SMILESCCN1C(C)(C)CC(=C2CC(C)(C)N(CC)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C22H42N2/c1-11-23-19(3,4)13-17(14-20(23,5)6)18-15-21(7,8)24(12-2)22(9,10)16-18/h11-16H2,1-10H3
InChIKeyZRTJNGYWBNZHAQ-UHFFFAOYSA-N
XLogP5.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.59
LogP ≤ 55.63
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-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine (CID 21401056) is 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine is CCN1C(C)(C)CC(=C2CC(C)(C)N(CC)C(C)(C)C2)CC1(C)C.
What is the InChIKey of 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine?
The InChIKey is ZRTJNGYWBNZHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42N2/c1-11-23-19(3,4)13-17(14-20(23,5)6)18-15-21(7,8)24(12-2)22(9,10)16-18/h11-16H2,1-10H3.
What are the key properties of 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine?
1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine has a molecular weight of 334.59 g/mol, XLogP of 5.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-ylidene)-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 21401056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).