1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one

C25H48N4O3 — CID 23451960

IUPAC1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one
SMILESCC1(C)CC(N2CCN(C3CC(C)(C)N(CCO)C(C)(C)C3)C2=O)CC(C)(C)N1CCO
InChIInChI=1S/C25H48N4O3/c1-22(2)15-19(16-23(3,4)28(22)11-13-30)26-9-10-27(21(26)32)20-17-24(5,6)29(12-14-31)25(7,8)18-20/h19-20,30-31H,9-18H2,1-8H3
InChIKeyLBPPESBAVHHDSE-UHFFFAOYSA-N
MW452.68 g/mol
LogP2.75
Rot. Bonds6

About 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one

1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one (PubChem CID 23451960) has the molecular formula C25H48N4O3 and a molecular weight of 452.68 g/mol. Its IUPAC name is 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one
PubChem CID23451960
Molecular FormulaC25H48N4O3
Molecular Weight452.68 g/mol
Exact Mass452.37
IUPAC Name1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one
SMILESCC1(C)CC(N2CCN(C3CC(C)(C)N(CCO)C(C)(C)C3)C2=O)CC(C)(C)N1CCO
InChIInChI=1S/C25H48N4O3/c1-22(2)15-19(16-23(3,4)28(22)11-13-30)26-9-10-27(21(26)32)20-17-24(5,6)29(12-14-31)25(7,8)18-20/h19-20,30-31H,9-18H2,1-8H3
InChIKeyLBPPESBAVHHDSE-UHFFFAOYSA-N
XLogP2.75
TPSA70.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.68
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one (CID 23451960) is 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one is CC1(C)CC(N2CCN(C3CC(C)(C)N(CCO)C(C)(C)C3)C2=O)CC(C)(C)N1CCO.
What is the InChIKey of 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one?
The InChIKey is LBPPESBAVHHDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H48N4O3/c1-22(2)15-19(16-23(3,4)28(22)11-13-30)26-9-10-27(21(26)32)20-17-24(5,6)29(12-14-31)25(7,8)18-20/h19-20,30-31H,9-18H2,1-8H3.
What are the key properties of 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one?
1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one has a molecular weight of 452.68 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 23451960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).