3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

C27H48N2O2 — CID 150658011

IUPAC3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESC=CN1C(C)(C)CC(N2C(=O)CC(CCCCCCCCCCCC)C2=O)CC1(C)C
InChIInChI=1S/C27H48N2O2/c1-7-9-10-11-12-13-14-15-16-17-18-22-19-24(30)29(25(22)31)23-20-26(3,4)28(8-2)27(5,6)21-23/h8,22-23H,2,7,9-21H2,1,3-6H3
InChIKeyJDGLAKFUCUJXQI-UHFFFAOYSA-N
MW432.69 g/mol
LogP6.84
Rot. Bonds13

About 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione

3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (PubChem CID 150658011) has the molecular formula C27H48N2O2 and a molecular weight of 432.69 g/mol. Its IUPAC name is 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
PubChem CID150658011
Molecular FormulaC27H48N2O2
Molecular Weight432.69 g/mol
Exact Mass432.37
IUPAC Name3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
SMILESC=CN1C(C)(C)CC(N2C(=O)CC(CCCCCCCCCCCC)C2=O)CC1(C)C
InChIInChI=1S/C27H48N2O2/c1-7-9-10-11-12-13-14-15-16-17-18-22-19-24(30)29(25(22)31)23-20-26(3,4)28(8-2)27(5,6)21-23/h8,22-23H,2,7,9-21H2,1,3-6H3
InChIKeyJDGLAKFUCUJXQI-UHFFFAOYSA-N
XLogP6.84
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.69
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3S)-3-dodecyl-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 98053180
3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;propane-1,3-diamine
CID 23086802
3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;octadecanoic acid
CID 24845441
ethyl 2-[4-(3-dodecyl-2,5-dioxopyrrolidin-1-yl)-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropanoate
CID 58420820
3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;1,2,2,3-tetramethylpiperidine
CID 174334288
3-[(E)-oct-1-enyl]-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 68555104
bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;3-dodecyl-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;(2,2,6,6-tetramethylpiperidin-4-yl) propanoate
CID 158514926
3-butyl-1-hydroxypyrrolidine-2,5-dione
CID 59622423
2-pentadecylcyclopropan-1-one
CID 70874004
3,3-didecyl-1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 57148925
1-[2-[2-[2-[2-(2,5-dioxo-3-tetracontylpyrrolidin-1-yl)ethylamino]ethylamino]ethylamino]ethyl]-3-tetracontylpyrrolidine-2,5-dione
CID 90684404
1-[2-[2-[2-[2-(3-dotetracontyl-2,5-dioxopyrrolidin-1-yl)ethylamino]ethylamino]ethylamino]ethyl]-3-tetracontylpyrrolidine-2,5-dione
CID 101132594

Frequently Asked Questions

What is the IUPAC name of 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The IUPAC name of 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione (CID 150658011) is 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is C=CN1C(C)(C)CC(N2C(=O)CC(CCCCCCCCCCCC)C2=O)CC1(C)C.
What is the InChIKey of 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
The InChIKey is JDGLAKFUCUJXQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H48N2O2/c1-7-9-10-11-12-13-14-15-16-17-18-22-19-24(30)29(25(22)31)23-20-26(3,4)28(8-2)27(5,6)21-23/h8,22-23H,2,7,9-21H2,1,3-6H3.
What are the key properties of 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione?
3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione has a molecular weight of 432.69 g/mol, XLogP of 6.84, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dodecyl-1-(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 150658011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).