1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine

C19H29NO — CID 102123971

IUPAC1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine
SMILESC=Cc1ccc(C(C)ON2C(C)(C)CCCC2(C)C)cc1
InChIInChI=1S/C19H29NO/c1-7-16-9-11-17(12-10-16)15(2)21-20-18(3,4)13-8-14-19(20,5)6/h7,9-12,15H,1,8,13-14H2,2-6H3
InChIKeyKVEPVFKLGITQKF-UHFFFAOYSA-N
MW287.45 g/mol
LogP5.37
Rot. Bonds4

About 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine

1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine (PubChem CID 102123971) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine
PubChem CID102123971
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine
SMILESC=Cc1ccc(C(C)ON2C(C)(C)CCCC2(C)C)cc1
InChIInChI=1S/C19H29NO/c1-7-16-9-11-17(12-10-16)15(2)21-20-18(3,4)13-8-14-19(20,5)6/h7,9-12,15H,1,8,13-14H2,2-6H3
InChIKeyKVEPVFKLGITQKF-UHFFFAOYSA-N
XLogP5.37
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.45
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,6,6-tetramethyl-1-[1-[4-[4-[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]phenyl]phenyl]ethoxy]piperidine
CID 154573678
N-[4-[3,5-bis[4-[[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]methylideneamino]phenoxy]phenoxy]phenyl]-1-[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]methanimine
CID 101371647
1-[1-[4-[[3,5-bis[[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]methoxymethyl]phenyl]methoxymethyl]phenyl]ethoxy]-2,2,6,6-tetramethylpiperidine
CID 101371646
[2-(4-ethenylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl] 1-ethoxyethyl carbonate
CID 139826886
1-[1-[4-[[3-[3,5-bis[3,5-bis[[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]methoxy]phenoxy]phenoxy]-5-[[4-[1-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethyl]phenyl]methoxy]phenoxy]methyl]phenyl]ethoxy]-2,2,6,6-tetramethylpiperidine
CID 102245531
2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)-3,3-bis(prop-2-enoxy)piperidine
CID 69490477
1-[1-(4-ethenylphenyl)ethyl]azepane
CID 66742661
1-[1-(4-ethenylphenyl)-3-hydroxypropan-2-yl]oxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 163543719
3-(2,2,6,6-tetramethylpiperidin-1-yl)oxybutan-2-ol
CID 91549508
2,2,5-trimethyl-5-phenyl-1-(1-phenylethoxy)pyrrolidine
CID 71391438
(2R)-2-(4-methylphenyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethanol
CID 102583972
[2-(4-ethenylphenyl)-2-(2,2,4,6,6-pentamethylpiperidin-1-yl)oxyethyl] propan-2-yl carbonate
CID 139895201

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine (CID 102123971) is 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine is C=Cc1ccc(C(C)ON2C(C)(C)CCCC2(C)C)cc1.
What is the InChIKey of 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine?
The InChIKey is KVEPVFKLGITQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-7-16-9-11-17(12-10-16)15(2)21-20-18(3,4)13-8-14-19(20,5)6/h7,9-12,15H,1,8,13-14H2,2-6H3.
What are the key properties of 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine?
1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine has a molecular weight of 287.45 g/mol, XLogP of 5.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-ethenylphenyl)ethoxy]-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 102123971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).