2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine

C20H37N — CID 71367480

IUPAC2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine
SMILESC=CCCCCCCCCC=C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C20H37N/c1-6-7-8-9-10-11-12-13-14-15-18-16-19(2,3)21-20(4,5)17-18/h6,15,21H,1,7-14,16-17H2,2-5H3
InChIKeyWLVIQZKJRLSQCS-UHFFFAOYSA-N
MW291.52 g/mol
LogP6.16
Rot. Bonds9

About 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine

2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine (PubChem CID 71367480) has the molecular formula C20H37N and a molecular weight of 291.52 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine
PubChem CID71367480
Molecular FormulaC20H37N
Molecular Weight291.52 g/mol
Exact Mass291.29
IUPAC Name2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine
SMILESC=CCCCCCCCCC=C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C20H37N/c1-6-7-8-9-10-11-12-13-14-15-18-16-19(2,3)21-20(4,5)17-18/h6,15,21H,1,7-14,16-17H2,2-5H3
InChIKeyWLVIQZKJRLSQCS-UHFFFAOYSA-N
XLogP6.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.52
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
1-hept-6-enylidene-3-methylcyclopentane
CID 173177618
(2R)-2-dec-9-enyl-2-methyloxetane
CID 102038104
pent-1-ene;pentylidenecyclopropane
CID 173050436
(3Z)-3-hept-6-enylidenecyclopentan-1-amine
CID 107010634
octadec-1-ene;tetradec-1-ene
CID 158470925
3-methyl-3-pent-4-enoxyazetidine
CID 83067660
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine?
The IUPAC name of 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine (CID 71367480) is 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine is C=CCCCCCCCCC=C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine?
The InChIKey is WLVIQZKJRLSQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37N/c1-6-7-8-9-10-11-12-13-14-15-18-16-19(2,3)21-20(4,5)17-18/h6,15,21H,1,7-14,16-17H2,2-5H3.
What are the key properties of 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine?
2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine has a molecular weight of 291.52 g/mol, XLogP of 6.16, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-4-undec-10-enylidenepiperidine is sourced from PubChem (CID 71367480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).